Chembl265137

Chemical Properties

SMILES COc1ccc(C[C@@H](NC(=O)c2ccc(C(=O)c3ccccc3)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc2ccc(O)c(I)c2)C(N)=O)cc1
Hydrogen bond acceptors 16
Hydrogen bond donors 15
Rotatable bonds 38
Molecular weight 1489.5

Drug Properties

Type Small molecule
Endogenous No
Approved No
InChIKey JISZVQDLLQSZFN-FETOTSAZSA-N

Database Connections

External Links

Bioactivity

Receptor Experimental Data Source
GTP Uniprot Species Family Class Type Min Avg Max Database
V1A V1AR Human Vasopressin and oxytocin A pKi 7.75 7.75 7.75 ChEMBL