CHEMBL1259188


SMILES Cn1nnc(Cc2ccc3c(c2)c(C2CCN(CCN4CCNC4=O)CC2)cn3-c2ccc(F)cc2)n1
InChIKey FGHKCRNDQSRICR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 502.3

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
α1B ADA1B Golden hamster Adrenoceptors A pKi 9.25 9.25 9.25 ChEMBL
α1A ADA1A Bovine Adrenoceptors A pKi 9.18 9.18 9.18 ChEMBL
α1D ADA1D Rat Adrenoceptors A pKi 9.11 9.11 9.11 ChEMBL
D2 DRD2 Human Dopamine A pKi 8.57 8.57 8.57 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database