CHEMBL4574065


SMILES CC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CSC[C@H]2C(=O)NCCCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O
InChIKey KMFSARJWXULJLV-MWSMAVIUSA-N

Chemical properties

Hydrogen bond acceptors 11
Hydrogen bond donors 10
Rotatable bonds 14
Molecular weight (Da) 975.4

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
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
V1B V1BR Human Vasopressin and oxytocin A pEC50 6.96 6.96 6.96 ChEMBL
V2 V2R Human Vasopressin and oxytocin A pEC50 9.66 9.66 9.66 ChEMBL