Molecule Details
InChIKeyDPEJMBKGRAFMDY-NZHOUOPXSA-N
Compound NameN-[2-[[(4R,4aS,7aR,12bR)-3-(cyclopropylmethyl)-9-hydroxy-7-oxo-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-4a-yl]amino]-2-oxoethyl]pyridine-2-carboxamide
Canonical SMILESO=C(CNC(=O)c1ccccn1)N[C@@]12CCC(=O)[C@@H]3Oc4c(O)ccc5c4[C@@]31CCN(CC1CC1)[C@@H]2C5
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL9.6
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P41145 OPRK1 Homo sapiens Human PF00001 9.8 Ki ChEMBL;BindingDB
P35372 OPRM1 Homo sapiens Human PF00001 9.5 Ki ChEMBL;BindingDB
P41143 OPRD1 Homo sapiens Human PF00001 9.4 Ki ChEMBL;BindingDB