CHEMBL4455496


SMILES CCCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CSCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1
InChIKey JTTSTAXQEWUOEM-FPWPIVABSA-N

Chemical properties

Hydrogen bond acceptors 13
Hydrogen bond donors 11
Rotatable bonds 17
Molecular weight (Da) 1048.4

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

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 6.92 6.92 6.92 ChEMBL
V2 V2R Human Vasopressin and oxytocin A pEC50 9.68 9.68 9.68 ChEMBL