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Compile Data Set for Download or QSAR

Found 477 hits of ic50 for UniProtKB: P08909   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001778
PNG
((Lu 23-086)1-(2-{4-[1-(4-Fluoro-phenyl)-1H-indol-3...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2ccccc12
Show InChI InChI=1S/C24H27FN4O/c25-19-5-7-20(8-6-19)29-17-22(21-3-1-2-4-23(21)29)18-9-12-27(13-10-18)15-16-28-14-11-26-24(28)30/h1-8,17-18H,9-16H2,(H,26,30)
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n/an/a 0.0820n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 1092-101 (1992)


BindingDB Entry DOI: 10.7270/Q2Z89BB3
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50010041
PNG
(CHEMBL84087 | {1-[3-(1,1-Dioxo-1H-1lambda*6*-napht...)
Show SMILES Fc1ccc(cc1)C(=O)C1CCN(CCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
Show InChI InChI=1S/C25H25FN2O3S/c26-21-10-8-19(9-11-21)25(29)20-12-16-27(17-13-20)14-3-15-28-22-6-1-4-18-5-2-7-23(24(18)22)32(28,30)31/h1-2,4-11,20H,3,12-17H2
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n/an/a 0.100n/an/an/an/an/an/a



Centre de Recherches de Vitry Alfortville Rh£ne-Poulenc Rorer

Curated by ChEMBL




J Med Chem 34: 2477-83 (1991)


BindingDB Entry DOI: 10.7270/Q2R78FT1
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50010048
PNG
(2-[3-(4-Phenyl-piperidin-1-yl)-propyl]-2H-naphtho[...)
Show SMILES O=S1(=O)N(CCCN2CCC(CC2)c2ccccc2)c2cccc3cccc1c23
Show InChI InChI=1S/C24H26N2O2S/c27-29(28)23-12-5-10-21-9-4-11-22(24(21)23)26(29)16-6-15-25-17-13-20(14-18-25)19-7-2-1-3-8-19/h1-5,7-12,20H,6,13-18H2
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n/an/a 0.200n/an/an/an/an/an/a



Centre de Recherches de Vitry Alfortville Rh£ne-Poulenc Rorer

Curated by ChEMBL




J Med Chem 34: 2477-83 (1991)


BindingDB Entry DOI: 10.7270/Q2R78FT1
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001991
PNG
(1-(2-{4-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-y...)
Show SMILES CN1CCN(CCN2CCC(CC2)c2cn(-c3ccc(F)cc3)c3ccc(Cl)cc23)C1=O
Show InChI InChI=1S/C25H28ClFN4O/c1-28-12-14-30(25(28)32)15-13-29-10-8-18(9-11-29)23-17-31(21-5-3-20(27)4-6-21)24-7-2-19(26)16-22(23)24/h2-7,16-18H,8-15H2,1H3
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n/an/a 0.240n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 1092-101 (1992)


BindingDB Entry DOI: 10.7270/Q2Z89BB3
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50010049
PNG
(4-{4-[3-(1,1-Dioxo-1H-1lambda*6*-naphtho[1,8-cd]is...)
Show SMILES Oc1ccc(cc1)N1CCN(CCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
Show InChI InChI=1S/C23H25N3O3S/c27-20-10-8-19(9-11-20)25-16-14-24(15-17-25)12-3-13-26-21-6-1-4-18-5-2-7-22(23(18)21)30(26,28)29/h1-2,4-11,27H,3,12-17H2
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n/an/a 0.300n/an/an/an/an/an/a



Centre de Recherches de Vitry Alfortville Rh£ne-Poulenc Rorer

Curated by ChEMBL




J Med Chem 34: 2477-83 (1991)


BindingDB Entry DOI: 10.7270/Q2R78FT1
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50002008
PNG
(1-(2-{4-[1-(4-Fluoro-phenyl)-5-methyl-1H-indol-3-y...)
Show SMILES Cc1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Show InChI InChI=1S/C25H29FN4O/c1-18-2-7-24-22(16-18)23(17-30(24)21-5-3-20(26)4-6-21)19-8-11-28(12-9-19)14-15-29-13-10-27-25(29)31/h2-7,16-17,19H,8-15H2,1H3,(H,27,31)
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n/an/a 0.300n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 1092-101 (1992)


BindingDB Entry DOI: 10.7270/Q2Z89BB3
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001990
PNG
(5-Chloro-1-(4-fluoro-phenyl)-3-(4-methyl-piperazin...)
Show SMILES CN1CCN(CC1)c1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C19H19ClFN3/c1-22-8-10-23(11-9-22)19-13-24(16-5-3-15(21)4-6-16)18-7-2-14(20)12-17(18)19/h2-7,12-13H,8-11H2,1H3
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n/an/a 0.300n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 1092-101 (1992)


BindingDB Entry DOI: 10.7270/Q2Z89BB3
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001786
PNG
(1-(2-{4-[5-chloro-1-(4-fluorophenyl)-1H-indol-3-yl...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(Cl)ccc12
Show InChI InChI=1S/C24H26ClFN4O/c25-18-1-6-23-21(15-18)22(16-30(23)20-4-2-19(26)3-5-20)17-7-10-28(11-8-17)13-14-29-12-9-27-24(29)31/h1-6,15-17H,7-14H2,(H,27,31)
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n/an/a 0.390n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 4813-22 (1993)


BindingDB Entry DOI: 10.7270/Q2G73CNK
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001786
PNG
(1-(2-{4-[5-chloro-1-(4-fluorophenyl)-1H-indol-3-yl...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(Cl)ccc12
Show InChI InChI=1S/C24H26ClFN4O/c25-18-1-6-23-21(15-18)22(16-30(23)20-4-2-19(26)3-5-20)17-7-10-28(11-8-17)13-14-29-12-9-27-24(29)31/h1-6,15-17H,7-14H2,(H,27,31)
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n/an/a 0.390n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 4823-31 (1993)


BindingDB Entry DOI: 10.7270/Q2BK1B8P
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001775
PNG
((ritanserin)6-(2-{4-[Bis-(4-fluoro-phenyl)-methyle...)
Show SMILES [#6]-c1nc2sccn2c(=O)c1-[#6]-[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6](\c1ccc(F)cc1)-c1ccc(F)cc1
Show InChI InChI=1S/C27H25F2N3OS/c1-18-24(26(33)32-16-17-34-27(32)30-18)12-15-31-13-10-21(11-14-31)25(19-2-6-22(28)7-3-19)20-4-8-23(29)9-5-20/h2-9,16-17H,10-15H2,1H3
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n/an/a 0.400n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 4823-31 (1993)


BindingDB Entry DOI: 10.7270/Q2BK1B8P
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001775
PNG
((ritanserin)6-(2-{4-[Bis-(4-fluoro-phenyl)-methyle...)
Show SMILES [#6]-c1nc2sccn2c(=O)c1-[#6]-[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6](\c1ccc(F)cc1)-c1ccc(F)cc1
Show InChI InChI=1S/C27H25F2N3OS/c1-18-24(26(33)32-16-17-34-27(32)30-18)12-15-31-13-10-21(11-14-31)25(19-2-6-22(28)7-3-19)20-4-8-23(29)9-5-20/h2-9,16-17H,10-15H2,1H3
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n/an/a 0.400n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 4813-22 (1993)


BindingDB Entry DOI: 10.7270/Q2G73CNK
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001775
PNG
((ritanserin)6-(2-{4-[Bis-(4-fluoro-phenyl)-methyle...)
Show SMILES [#6]-c1nc2sccn2c(=O)c1-[#6]-[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6](\c1ccc(F)cc1)-c1ccc(F)cc1
Show InChI InChI=1S/C27H25F2N3OS/c1-18-24(26(33)32-16-17-34-27(32)30-18)12-15-31-13-10-21(11-14-31)25(19-2-6-22(28)7-3-19)20-4-8-23(29)9-5-20/h2-9,16-17H,10-15H2,1H3
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n/an/a 0.400n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 36: 2761-70 (1993)


BindingDB Entry DOI: 10.7270/Q2B858RJ
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50010038
PNG
(2-[3-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-pr...)
Show SMILES O=S1(=O)N(CCCN2CCN(CC2)c2nsc3ccccc23)c2cccc3cccc1c23
Show InChI InChI=1S/C24H24N4O2S2/c29-32(30)22-11-4-7-18-6-3-9-20(23(18)22)28(32)13-5-12-26-14-16-27(17-15-26)24-19-8-1-2-10-21(19)31-25-24/h1-4,6-11H,5,12-17H2
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n/an/a 0.400n/an/an/an/an/an/a



Centre de Recherches de Vitry Alfortville Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Binding constant against dopamine receptor D2 (in vivo)


J Med Chem 34: 2477-83 (1991)


BindingDB Entry DOI: 10.7270/Q2R78FT1
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50007692
PNG
(8-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(CC1)c1nsc2ccccc12
Show InChI InChI=1S/C24H32N4O2S/c29-21-17-24(9-3-4-10-24)18-22(30)28(21)12-6-5-11-26-13-15-27(16-14-26)23-19-7-1-2-8-20(19)31-25-23/h1-2,7-8H,3-6,9-18H2
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n/an/a 0.400n/an/an/an/an/an/a



TBA

Curated by ChEMBL




J Med Chem 29: 359-69 (1986)


BindingDB Entry DOI: 10.7270/Q24X58C9
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001786
PNG
(1-(2-{4-[5-chloro-1-(4-fluorophenyl)-1H-indol-3-yl...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(Cl)ccc12
Show InChI InChI=1S/C24H26ClFN4O/c25-18-1-6-23-21(15-18)22(16-30(23)20-4-2-19(26)3-5-20)17-7-10-28(11-8-17)13-14-29-12-9-27-24(29)31/h1-6,15-17H,7-14H2,(H,27,31)
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n/an/a 0.480n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 1092-101 (1992)


BindingDB Entry DOI: 10.7270/Q2Z89BB3
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50002001
PNG
(1-(2-{4-[5-Fluoro-1-(4-fluoro-phenyl)-1H-indol-3-y...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(F)ccc12
Show InChI InChI=1S/C24H26F2N4O/c25-18-1-4-20(5-2-18)30-16-22(21-15-19(26)3-6-23(21)30)17-7-10-28(11-8-17)13-14-29-12-9-27-24(29)31/h1-6,15-17H,7-14H2,(H,27,31)
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n/an/a 0.480n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 1092-101 (1992)


BindingDB Entry DOI: 10.7270/Q2Z89BB3
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50007567
PNG
(1-(8-Chloro-10,11-dihydro-dibenzo[b,f]thiepin-10-y...)
Show SMILES CN1CCN(CC1)[C@@H]1Cc2ccccc2Sc2ccc(Cl)cc12
Show InChI InChI=1S/C19H21ClN2S/c1-21-8-10-22(11-9-21)17-12-14-4-2-3-5-18(14)23-19-7-6-15(20)13-16(17)19/h2-7,13,17H,8-12H2,1H3/t17-/m1/s1
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n/an/a 0.480n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 34: 2023-30 (1991)


BindingDB Entry DOI: 10.7270/Q2KD1WVC
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50007568
PNG
(1-((S)-8-Chloro-10,11-dihydro-dibenzo[b,f]thiepin-...)
Show SMILES CN1CCN(CC1)[C@H]1Cc2ccccc2Sc2ccc(Cl)cc12
Show InChI InChI=1S/C19H21ClN2S/c1-21-8-10-22(11-9-21)17-12-14-4-2-3-5-18(14)23-19-7-6-15(20)13-16(17)19/h2-7,13,17H,8-12H2,1H3/t17-/m0/s1
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n/an/a 0.480n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 34: 2023-30 (1991)


BindingDB Entry DOI: 10.7270/Q2KD1WVC
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50010044
PNG
(2-{3-[4-(4-Fluoro-phenyl)-piperazin-1-yl]-propyl}-...)
Show SMILES Fc1ccc(cc1)N1CCN(CCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
Show InChI InChI=1S/C23H24FN3O2S/c24-19-8-10-20(11-9-19)26-16-14-25(15-17-26)12-3-13-27-21-6-1-4-18-5-2-7-22(23(18)21)30(27,28)29/h1-2,4-11H,3,12-17H2
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n/an/a 0.5n/an/an/an/an/an/a



Centre de Recherches de Vitry Alfortville Rh£ne-Poulenc Rorer

Curated by ChEMBL




J Med Chem 34: 2477-83 (1991)


BindingDB Entry DOI: 10.7270/Q2R78FT1
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50002015
PNG
(5-Chloro-1-(4-fluoro-phenyl)-3-(1-methyl-1,2,3,6-t...)
Show SMILES CN1CCC(=CC1)c1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12 |c:4|
Show InChI InChI=1S/C20H18ClFN2/c1-23-10-8-14(9-11-23)19-13-24(17-5-3-16(22)4-6-17)20-7-2-15(21)12-18(19)20/h2-8,12-13H,9-11H2,1H3
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n/an/a 0.530n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 1092-101 (1992)


BindingDB Entry DOI: 10.7270/Q2Z89BB3
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50025124
PNG
(3-{2-[4-(4-Fluoro-benzoyl)-piperidin-1-yl]-ethyl}-...)
Show SMILES Oc1ccc2c(c1)[nH]c(=O)n(CCN1CCC(CC1)C(=O)c1ccc(F)cc1)c2=O
Show InChI InChI=1S/C22H22FN3O4/c23-16-3-1-14(2-4-16)20(28)15-7-9-25(10-8-15)11-12-26-21(29)18-6-5-17(27)13-19(18)24-22(26)30/h1-6,13,15,27H,7-12H2,(H,24,30)
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n/an/a 0.562n/an/an/an/an/an/a



TBA

Curated by ChEMBL




J Med Chem 29: 1663-8 (1986)


BindingDB Entry DOI: 10.7270/Q2RX9B3N
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM22872
PNG
(1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-y...)
Show SMILES CN1CCN(CC1)C1Cc2ccccc2Sc2ccc(Cl)cc12
Show InChI InChI=1S/C19H21ClN2S/c1-21-8-10-22(11-9-21)17-12-14-4-2-3-5-18(14)23-19-7-6-15(20)13-16(17)19/h2-7,13,17H,8-12H2,1H3
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n/an/a 0.570n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 34: 2023-30 (1991)


BindingDB Entry DOI: 10.7270/Q2KD1WVC
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001797
PNG
(1-(2-{4-[1-(4-Fluoro-phenyl)-2-methyl-1H-indol-3-y...)
Show SMILES Cc1c(C2CCN(CCN3CCNC3=O)CC2)c2ccccc2n1-c1ccc(F)cc1
Show InChI InChI=1S/C25H29FN4O/c1-18-24(19-10-13-28(14-11-19)16-17-29-15-12-27-25(29)31)22-4-2-3-5-23(22)30(18)21-8-6-20(26)7-9-21/h2-9,19H,10-17H2,1H3,(H,27,31)
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n/an/a 0.590n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 4813-22 (1993)


BindingDB Entry DOI: 10.7270/Q2G73CNK
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001778
PNG
((Lu 23-086)1-(2-{4-[1-(4-Fluoro-phenyl)-1H-indol-3...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2ccccc12
Show InChI InChI=1S/C24H27FN4O/c25-19-5-7-20(8-6-19)29-17-22(21-3-1-2-4-23(21)29)18-9-12-27(13-10-18)15-16-28-14-11-26-24(28)30/h1-8,17-18H,9-16H2,(H,26,30)
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n/an/a 0.720n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 4813-22 (1993)


BindingDB Entry DOI: 10.7270/Q2G73CNK
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001790
PNG
(1-(2-{4-[6-Fluoro-1-(4-fluoro-phenyl)-1H-indol-3-y...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2ccc(F)cc12
Show InChI InChI=1S/C24H26F2N4O/c25-18-1-4-20(5-2-18)30-16-22(21-6-3-19(26)15-23(21)30)17-7-10-28(11-8-17)13-14-29-12-9-27-24(29)31/h1-6,15-17H,7-14H2,(H,27,31)
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n/an/a 0.730n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 4813-22 (1993)


BindingDB Entry DOI: 10.7270/Q2G73CNK
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50368668
PNG
(CHEMBL1788128)
Show SMILES Fc1ccc(cc1)C1CC(N2CCN(CCN3CCCNC3=S)CC2)c2ccc(Cl)cc12
Show InChI InChI=1S/C25H30ClFN4S/c26-19-4-7-21-23(16-19)22(18-2-5-20(27)6-3-18)17-24(21)30-13-10-29(11-14-30)12-15-31-9-1-8-28-25(31)32/h2-7,16,22,24H,1,8-15,17H2,(H,28,32)
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H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 36: 2761-70 (1993)


BindingDB Entry DOI: 10.7270/Q2B858RJ
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001885
PNG
((risperidone)3-{2-[4-(6-Fluoro-benzo[d]isoxazol-3-...)
Show SMILES Cc1nc2CCCCn2c(=O)c1CCN1CCC(CC1)c1noc2cc(F)ccc12
Show InChI InChI=1S/C23H27FN4O2/c1-15-18(23(29)28-10-3-2-4-21(28)25-15)9-13-27-11-7-16(8-12-27)22-19-6-5-17(24)14-20(19)30-26-22/h5-6,14,16H,2-4,7-13H2,1H3
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n/an/a 0.760n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 1092-101 (1992)


BindingDB Entry DOI: 10.7270/Q2Z89BB3
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001796
PNG
(1-(2-{4-[1-(4-Fluoro-phenyl)-6-methyl-1H-indol-3-y...)
Show SMILES Cc1ccc2c(cn(-c3ccc(F)cc3)c2c1)C1CCN(CCN2CCNC2=O)CC1
Show InChI InChI=1S/C25H29FN4O/c1-18-2-7-22-23(17-30(24(22)16-18)21-5-3-20(26)4-6-21)19-8-11-28(12-9-19)14-15-29-13-10-27-25(29)31/h2-7,16-17,19H,8-15H2,1H3,(H,27,31)
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n/an/a 0.820n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 4813-22 (1993)


BindingDB Entry DOI: 10.7270/Q2G73CNK
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50230290
PNG
(CHEMBL344273 | MDL-28161)
Show SMILES OC(C1CCN(CCc2ccc(F)cc2)CC1)c1ccccc1
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Virginia Commonwealth University

Curated by ChEMBL




J Med Chem 35: 4903-10 (1993)


BindingDB Entry DOI: 10.7270/Q26T0N86
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50368656
PNG
(CHEMBL1204307 | CHEMBL1744111)
Show SMILES Fc1ccc(cc1)C1CC(N2CCN(CCN3CCCNC3=S)CC2)c2ccc(F)cc12
Show InChI InChI=1S/C25H30F2N4S/c26-19-4-2-18(3-5-19)22-17-24(21-7-6-20(27)16-23(21)22)30-13-10-29(11-14-30)12-15-31-9-1-8-28-25(31)32/h2-7,16,22,24H,1,8-15,17H2,(H,28,32)
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H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 36: 2761-70 (1993)


BindingDB Entry DOI: 10.7270/Q2B858RJ
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50002014
PNG
(1-(2-{4-[1-(4-Fluoro-phenyl)-5-methoxy-1H-indol-3-...)
Show SMILES COc1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Show InChI InChI=1S/C25H29FN4O2/c1-32-21-6-7-24-22(16-21)23(17-30(24)20-4-2-19(26)3-5-20)18-8-11-28(12-9-18)14-15-29-13-10-27-25(29)31/h2-7,16-18H,8-15H2,1H3,(H,27,31)
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H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 1092-101 (1992)


BindingDB Entry DOI: 10.7270/Q2Z89BB3
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50002004
PNG
(1-(3-{4-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-y...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCCN3CCNC3=O)CC2)c2cc(Cl)ccc12
Show InChI InChI=1S/C25H28ClFN4O/c26-19-2-7-24-22(16-19)23(17-31(24)21-5-3-20(27)4-6-21)18-8-13-29(14-9-18)11-1-12-30-15-10-28-25(30)32/h2-7,16-18H,1,8-15H2,(H,28,32)
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H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 1092-101 (1992)


BindingDB Entry DOI: 10.7270/Q2Z89BB3
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50229423
PNG
(CHEMBL82229)
Show SMILES Fc1ccc(cc1)N1CCN(CCN2c3cccc4cccc(c34)S2(=O)=O)CC1
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Centre de Recherches de Vitry Alfortville Rh£ne-Poulenc Rorer

Curated by ChEMBL




J Med Chem 34: 2477-83 (1991)


BindingDB Entry DOI: 10.7270/Q2R78FT1
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50010040
PNG
(2-[3-(4-Phenyl-3,6-dihydro-2H-pyridin-1-yl)-propyl...)
Show SMILES O=S1(=O)N(CCCN2CCC(=CC2)c2ccccc2)c2cccc3cccc1c23 |c:10|
Show InChI InChI=1S/C24H24N2O2S/c27-29(28)23-12-5-10-21-9-4-11-22(24(21)23)26(29)16-6-15-25-17-13-20(14-18-25)19-7-2-1-3-8-19/h1-5,7-13H,6,14-18H2
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n/an/a 1n/an/an/an/an/an/a



Centre de Recherches de Vitry Alfortville Rh£ne-Poulenc Rorer

Curated by ChEMBL




J Med Chem 34: 2477-83 (1991)


BindingDB Entry DOI: 10.7270/Q2R78FT1
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001997
PNG
(1-(2-{4-[1-(4-Fluoro-phenyl)-5-trifluoromethyl-1H-...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(ccc12)C(F)(F)F
Show InChI InChI=1S/C25H26F4N4O/c26-19-2-4-20(5-3-19)33-16-22(21-15-18(25(27,28)29)1-6-23(21)33)17-7-10-31(11-8-17)13-14-32-12-9-30-24(32)34/h1-6,15-17H,7-14H2,(H,30,34)
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H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 1092-101 (1992)


BindingDB Entry DOI: 10.7270/Q2Z89BB3
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50368661
PNG
(CHEMBL1744121)
Show SMILES CC(C)N1CCN(CCN2CCN(CC2)C2CC(c3cc(Cl)ccc23)c2ccc(F)cc2)C1=O
Show InChI InChI=1S/C27H34ClFN4O/c1-19(2)33-16-15-32(27(33)34)14-11-30-9-12-31(13-10-30)26-18-24(20-3-6-22(29)7-4-20)25-17-21(28)5-8-23(25)26/h3-8,17,19,24,26H,9-16,18H2,1-2H3
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n/an/a 1.10n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 36: 2761-70 (1993)


BindingDB Entry DOI: 10.7270/Q2B858RJ
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50368675
PNG
(CHEMBL1744113)
Show SMILES Fc1ccc(cc1)C1CC(N2CCN(CCN3CCCNC3=O)CC2)c2ccc(F)cc12
Show InChI InChI=1S/C25H30F2N4O/c26-19-4-2-18(3-5-19)22-17-24(21-7-6-20(27)16-23(21)22)30-13-10-29(11-14-30)12-15-31-9-1-8-28-25(31)32/h2-7,16,22,24H,1,8-15,17H2,(H,28,32)
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n/an/a 1.10n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 36: 2761-70 (1993)


BindingDB Entry DOI: 10.7270/Q2B858RJ
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001776
PNG
(1-(2-{4-[1-(4-Fluoro-phenyl)-2-methyl-1H-indol-3-y...)
Show SMILES Cc1c(C2=CCN(CCN3CCNC3=O)CC2)c2ccccc2n1-c1ccc(F)cc1 |t:3|
Show InChI InChI=1S/C25H27FN4O/c1-18-24(19-10-13-28(14-11-19)16-17-29-15-12-27-25(29)31)22-4-2-3-5-23(22)30(18)21-8-6-20(26)7-9-21/h2-10H,11-17H2,1H3,(H,27,31)
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H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 4813-22 (1993)


BindingDB Entry DOI: 10.7270/Q2G73CNK
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50002013
PNG
(1-(2-{4-[5-Bromo-1-(4-fluoro-phenyl)-1H-indol-3-yl...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(Br)ccc12
Show InChI InChI=1S/C24H26BrFN4O/c25-18-1-6-23-21(15-18)22(16-30(23)20-4-2-19(26)3-5-20)17-7-10-28(11-8-17)13-14-29-12-9-27-24(29)31/h1-6,15-17H,7-14H2,(H,27,31)
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n/an/a 1.30n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 1092-101 (1992)


BindingDB Entry DOI: 10.7270/Q2Z89BB3
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50368657
PNG
(CHEMBL1744114)
Show SMILES Fc1ccc(cc1)C1CC(N2CCN(CCN3CCCNC3=O)CC2)c2ccc(Cl)cc12
Show InChI InChI=1S/C25H30ClFN4O/c26-19-4-7-21-23(16-19)22(18-2-5-20(27)6-3-18)17-24(21)30-13-10-29(11-14-30)12-15-31-9-1-8-28-25(31)32/h2-7,16,22,24H,1,8-15,17H2,(H,28,32)
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n/an/a 1.30n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 36: 2761-70 (1993)


BindingDB Entry DOI: 10.7270/Q2B858RJ
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001789
PNG
(1-(2-{4-[6-Fluoro-1-(4-fluoro-phenyl)-1H-indol-3-y...)
Show SMILES CC(C)N1CCN(CCN2CCC(CC2)c2cn(-c3ccc(F)cc3)c3cc(F)ccc23)C1=O
Show InChI InChI=1S/C27H32F2N4O/c1-19(2)32-16-15-31(27(32)34)14-13-30-11-9-20(10-12-30)25-18-33(23-6-3-21(28)4-7-23)26-17-22(29)5-8-24(25)26/h3-8,17-20H,9-16H2,1-2H3
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n/an/a 1.30n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 4813-22 (1993)


BindingDB Entry DOI: 10.7270/Q2G73CNK
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001784
PNG
(3-(2-{4-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-y...)
Show SMILES CN(C)C(=O)NCCN1CCC(CC1)c1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
Show InChI InChI=1S/C24H28ClFN4O/c1-28(2)24(31)27-11-14-29-12-9-17(10-13-29)22-16-30(20-6-4-19(26)5-7-20)23-15-18(25)3-8-21(22)23/h3-8,15-17H,9-14H2,1-2H3,(H,27,31)
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n/an/a 1.30n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 4813-22 (1993)


BindingDB Entry DOI: 10.7270/Q2G73CNK
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50002000
PNG
(1-(4-Fluoro-phenyl)-3-{1-[2-(2-oxo-imidazolidin-1-...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(ccc12)C#N
Show InChI InChI=1S/C25H26FN5O/c26-20-2-4-21(5-3-20)31-17-23(22-15-18(16-27)1-6-24(22)31)19-7-10-29(11-8-19)13-14-30-12-9-28-25(30)32/h1-6,15,17,19H,7-14H2,(H,28,32)
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H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 1092-101 (1992)


BindingDB Entry DOI: 10.7270/Q2Z89BB3
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001994
PNG
(2-{4-[1-(4-Fluoro-phenyl)-5-trifluoromethyl-1H-ind...)
Show SMILES OCCN1CCN(CC1)c1cn(-c2ccc(F)cc2)c2ccc(cc12)C(F)(F)F
Show InChI InChI=1S/C21H21F4N3O/c22-16-2-4-17(5-3-16)28-14-20(27-9-7-26(8-10-27)11-12-29)18-13-15(21(23,24)25)1-6-19(18)28/h1-6,13-14,29H,7-12H2
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H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 1092-101 (1992)


BindingDB Entry DOI: 10.7270/Q2Z89BB3
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001772
PNG
(1-(2-{4-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-y...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2ccc(Cl)cc12
Show InChI InChI=1S/C24H26ClFN4O/c25-18-1-6-21-22(16-30(23(21)15-18)20-4-2-19(26)3-5-20)17-7-10-28(11-8-17)13-14-29-12-9-27-24(29)31/h1-6,15-17H,7-14H2,(H,27,31)
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n/an/a 1.40n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 4813-22 (1993)


BindingDB Entry DOI: 10.7270/Q2G73CNK
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001811
PNG
(1-(2-{4-[3-(4-Fluoro-phenyl)-5-methyl-indol-1-yl]-...)
Show SMILES Cc1ccc2n(cc(-c3ccc(F)cc3)c2c1)C1=CCN(CCN2CCNC2=O)CC1 |t:20|
Show InChI InChI=1S/C25H27FN4O/c1-18-2-7-24-22(16-18)23(19-3-5-20(26)6-4-19)17-30(24)21-8-11-28(12-9-21)14-15-29-13-10-27-25(29)31/h2-8,16-17H,9-15H2,1H3,(H,27,31)
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n/an/a 1.5n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 4823-31 (1993)


BindingDB Entry DOI: 10.7270/Q2BK1B8P
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50001782
PNG
((Lu 26-042)1-(2-{4-[6-Chloro-1-(4-fluoro-phenyl)-1...)
Show SMILES CC(C)N1CCN(CCN2CCC(CC2)c2cn(-c3ccc(F)cc3)c3cc(Cl)ccc23)C1=O
Show InChI InChI=1S/C27H32ClFN4O/c1-19(2)32-16-15-31(27(32)34)14-13-30-11-9-20(10-12-30)25-18-33(23-6-4-22(29)5-7-23)26-17-21(28)3-8-24(25)26/h3-8,17-20H,9-16H2,1-2H3
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n/an/a 1.5n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 35: 4813-22 (1993)


BindingDB Entry DOI: 10.7270/Q2G73CNK
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50368662
PNG
(CHEMBL1744107)
Show SMILES Fc1ccc(cc1)C1CC(N2CCN(CCN3CCNC3=S)CC2)c2ccc(Cl)cc12
Show InChI InChI=1S/C24H28ClFN4S/c25-18-3-6-20-22(15-18)21(17-1-4-19(26)5-2-17)16-23(20)29-12-9-28(10-13-29)11-14-30-8-7-27-24(30)31/h1-6,15,21,23H,7-14,16H2,(H,27,31)
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n/an/a 1.5n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 36: 2761-70 (1993)


BindingDB Entry DOI: 10.7270/Q2B858RJ
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50368659
PNG
(CHEMBL1744112)
Show SMILES Fc1ccc(cc1)C1CC(N2CCN(CCN3CCNC3=S)CC2)c2ccc(F)cc12
Show InChI InChI=1S/C24H28F2N4S/c25-18-3-1-17(2-4-18)21-16-23(20-6-5-19(26)15-22(20)21)29-12-9-28(10-13-29)11-14-30-8-7-27-24(30)31/h1-6,15,21,23H,7-14,16H2,(H,27,31)
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n/an/a 1.5n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 36: 2761-70 (1993)


BindingDB Entry DOI: 10.7270/Q2B858RJ
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50368668
PNG
(CHEMBL1788128)
Show SMILES Fc1ccc(cc1)C1CC(N2CCN(CCN3CCCNC3=S)CC2)c2ccc(Cl)cc12
Show InChI InChI=1S/C25H30ClFN4S/c26-19-4-7-21-23(16-19)22(18-2-5-20(27)6-3-18)17-24(21)30-13-10-29(11-14-30)12-15-31-9-1-8-28-25(31)32/h2-7,16,22,24H,1,8-15,17H2,(H,28,32)
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n/an/a 1.5n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL




J Med Chem 36: 2761-70 (1993)


BindingDB Entry DOI: 10.7270/Q2B858RJ
More data for this
Ligand-Target Pair
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