BDBM50493361 CHEMBL2425429

SMILES: OC(=O)C(F)(F)F.N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCCO

InChI Key: InChIKey=FWYDQVXTMOYUOM-IEGYNWRZSA-N

Data: 2 KI  2 IC50

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 4 hits for monomerid = 50493361   

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
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50493361 (CHEMBL2425429) Show SMILES OC(=O)C(F)(F)F.N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCCO |r| Show InChI InChI=1S/C34H41N5O6.C2HF3O2/c35-27(20-25-13-15-26(41)16-14-25)34(45)39-18-7-12-30(39)33(44)38-29(22-24-10-5-2-6-11-24)32(43)37-28(31(42)36-17-19-40)21-23-8-3-1-4-9-23;3-2(4,5)1(6)7/h1-6,8-11,13-16,27-30,40-41H,7,12,17-22,35H2,(H,36,42)(H,37,43)(H,38,44);(H,6,7)/t27-,28-,29-,30-;/m0./s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi "G. d'Annunzio" di Chieti-Pescara Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from mu opioid receptor in Wistar rat brain membranes by liquid scintillation counting				Eur J Med Chem 68: 167-77 (2013) Article DOI: 10.1016/j.ejmech.2013.07.044 BindingDB Entry DOI: 10.7270/Q2D79FCG
					More data for this Ligand-Target Pair
Opioid receptors; mu & delta (Rattus norvegicus (rat))	BDBM50493361 (CHEMBL2425429) Show SMILES OC(=O)C(F)(F)F.N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCCO |r| Show InChI InChI=1S/C34H41N5O6.C2HF3O2/c35-27(20-25-13-15-26(41)16-14-25)34(45)39-18-7-12-30(39)33(44)38-29(22-24-10-5-2-6-11-24)32(43)37-28(31(42)36-17-19-40)21-23-8-3-1-4-9-23;3-2(4,5)1(6)7/h1-6,8-11,13-16,27-30,40-41H,7,12,17-22,35H2,(H,36,42)(H,37,43)(H,38,44);(H,6,7)/t27-,28-,29-,30-;/m0./s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	799	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi "G. d'Annunzio" di Chieti-Pescara Curated by ChEMBL					Assay Description Displacement of [3H]Ile5,6deltorphin-2 from delta opioid receptor in Wistar rat brain membranes by liquid scintillation counting				Eur J Med Chem 68: 167-77 (2013) Article DOI: 10.1016/j.ejmech.2013.07.044 BindingDB Entry DOI: 10.7270/Q2D79FCG
					More data for this Ligand-Target Pair
Opioid receptors; mu & delta (Rattus norvegicus (rat))	BDBM50493361 (CHEMBL2425429) Show SMILES OC(=O)C(F)(F)F.N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCCO |r| Show InChI InChI=1S/C34H41N5O6.C2HF3O2/c35-27(20-25-13-15-26(41)16-14-25)34(45)39-18-7-12-30(39)33(44)38-29(22-24-10-5-2-6-11-24)32(43)37-28(31(42)36-17-19-40)21-23-8-3-1-4-9-23;3-2(4,5)1(6)7/h1-6,8-11,13-16,27-30,40-41H,7,12,17-22,35H2,(H,36,42)(H,37,43)(H,38,44);(H,6,7)/t27-,28-,29-,30-;/m0./s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+14	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi "G. d'Annunzio" di Chieti-Pescara Curated by ChEMBL					Assay Description Displacement of [3H]Ile5,6deltorphin-2 from delta opioid receptor in Wistar rat brain membranes by liquid scintillation counting				Eur J Med Chem 68: 167-77 (2013) Article DOI: 10.1016/j.ejmech.2013.07.044 BindingDB Entry DOI: 10.7270/Q2D79FCG
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50493361 (CHEMBL2425429) Show SMILES OC(=O)C(F)(F)F.N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCCO |r| Show InChI InChI=1S/C34H41N5O6.C2HF3O2/c35-27(20-25-13-15-26(41)16-14-25)34(45)39-18-7-12-30(39)33(44)38-29(22-24-10-5-2-6-11-24)32(43)37-28(31(42)36-17-19-40)21-23-8-3-1-4-9-23;3-2(4,5)1(6)7/h1-6,8-11,13-16,27-30,40-41H,7,12,17-22,35H2,(H,36,42)(H,37,43)(H,38,44);(H,6,7)/t27-,28-,29-,30-;/m0./s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+14	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi "G. d'Annunzio" di Chieti-Pescara Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from mu opioid receptor in Wistar rat brain membranes by liquid scintillation counting				Eur J Med Chem 68: 167-77 (2013) Article DOI: 10.1016/j.ejmech.2013.07.044 BindingDB Entry DOI: 10.7270/Q2D79FCG
					More data for this Ligand-Target Pair