CHEMBL3941520


SMILES Cc1nc(C(N)=O)ccc1-c1nnc(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)n1C
InChIKey WEEBXSDEOQNZPK-NLFFAJNJSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 530.2

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
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 6.73 6.73 6.73 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 6.29 6.29 6.29 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.9 9.04 9.17 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.68 5.81 5.94 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database