CHEMBL3901587


SMILES Cc1ncoc1-c1nnc(SCCCN2CC[C@@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3F)C2)n1C
InChIKey ZIQDGXNDXRMRPM-VGOFRKELSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 7
Molecular weight (Da) 495.2

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
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 6.26 6.26 6.26 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 6.86 6.86 6.86 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.18 8.2 8.21 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.01 6.05 6.1 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database