CHEMBL1673003


SMILES CN1C[C@H](C(=O)N[C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)N[C@@H](Cc2ccc(F)cc2)C(=O)N2CCCC(C(=O)NCCCCCC(=O)NCCCC[C@H](NC(=O)CCCC[C@H]3SC[C@H]4NC(=O)N[C@H]43)C(N)=O)C2)C=C2c3cccc4[nH]cc(c34)C[C@H]21
InChIKey OBSXBRKMRKLCPZ-PNIULUOKSA-N

Chemical properties

Hydrogen bond acceptors 12
Hydrogen bond donors 9
Rotatable bonds 29
Molecular weight (Da) 1202.6

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
D3 DRD3 Human Dopamine A pKd 7.03 7.33 7.64 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database