BMS-986104 derivative 12


SMILES CCOCCC[C@@H]1CCc2c(C1)ccc(c2)[C@H]1CC[C@](C1)(N)CO
InChIKey PYZTXDCPUPYILV-TYCQWZJGSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 331.3

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D4 DRD4 Human Dopamine A pKi 6.72 6.72 6.72 ChEMBL
D2 DRD2 Rat Dopamine A pKi 8.08 8.89 9.7 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 7.28 7.28 7.28 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.08 8.08 8.08 ChEMBL
D2 DRD2 Human Dopamine A pKi 8.01 8.01 8.01 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database