BDBM50053667 CHEMBL552643::Trifluoro-methanesulfonic acid (S)-7-{[4-(7,9-dioxo-8-aza-spiro[4.5]dec-8-yl)-butyl]-propyl-amino}-4-fluoro-5,6,7,8-tetrahydro-naphthalen-1-yl ester; hydrochloride

SMILES: CCCN(CCCCN1C(=O)CC2(CCCC2)CC1=O)[C@H]1CCc2c(F)ccc(OS(=O)(=O)C(F)(F)F)c2C1

InChI Key: InChIKey=WRNGQBSCUWORIS-IBGZPJMESA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50053667   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50053667 (CHEMBL552643 | Trifluoro-methanesulfonic acid (S)-...) Show SMILES CCCN(CCCCN1C(=O)CC2(CCCC2)CC1=O)[C@H]1CCc2c(F)ccc(OS(=O)(=O)C(F)(F)F)c2C1 Show InChI InChI=1S/C27H36F4N2O5S/c1-2-13-32(14-5-6-15-33-24(34)17-26(18-25(33)35)11-3-4-12-26)19-7-8-20-21(16-19)23(10-9-22(20)28)38-39(36,37)27(29,30)31/h9-10,19H,2-8,11-18H2,1H3/t19-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description Binding affinity against rat hippocampal 5-hydroxytryptamine 1A (5-HT1A) receptor determined using [3H]8-OH-DPAT as radioligand				J Med Chem 39: 4036-43 (1996) Article DOI: 10.1021/jm960329o BindingDB Entry DOI: 10.7270/Q2XK8G6C
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50053667 (CHEMBL552643 | Trifluoro-methanesulfonic acid (S)-...) Show SMILES CCCN(CCCCN1C(=O)CC2(CCCC2)CC1=O)[C@H]1CCc2c(F)ccc(OS(=O)(=O)C(F)(F)F)c2C1 Show InChI InChI=1S/C27H36F4N2O5S/c1-2-13-32(14-5-6-15-33-24(34)17-26(18-25(33)35)11-3-4-12-26)19-7-8-20-21(16-19)23(10-9-22(20)28)38-39(36,37)27(29,30)31/h9-10,19H,2-8,11-18H2,1H3/t19-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	177	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description Binding affinity against rat hippocampal 5-hydroxytryptamine 1A (5-HT1A) receptor determined using [3H]8-OH-DPAT as radioligand				J Med Chem 39: 4036-43 (1996) Article DOI: 10.1021/jm960329o BindingDB Entry DOI: 10.7270/Q2XK8G6C
					More data for this Ligand-Target Pair