MIFEPRISTONE


SMILES CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@@H](c3ccc(N(C)C)cc3)C[C@@]21C
InChIKey VKHAHZOOUSRJNA-GCNJZUOMSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 2
Molecular weight (Da) 429.3

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α2B ADA2B Human Adrenoceptors A pKi 4.92 4.92 4.92 ChEMBL
κ OPRK Human Opioid A pKi 5.09 5.09 5.09 ChEMBL
μ OPRM Human Opioid A pKi 6.0 6.0 6.0 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 8.31 8.31 8.31 Drug Central
κ OPRK Human Opioid A pKi 8.29 8.29 8.29 Drug Central
μ OPRM Human Opioid A pKi 8.22 8.22 8.22 Drug Central
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α2B ADA2B Human Adrenoceptors A pIC50 4.58 4.58 4.58 ChEMBL
NPS NPSR1 Human Neuropeptide S A Potency 4.9 4.9 4.9 ChEMBL
κ OPRK Human Opioid A pIC50 4.7 4.7 4.7 ChEMBL
μ OPRM Human Opioid A pIC50 5.61 5.61 5.61 ChEMBL