compound 37 [PMID: 16250654]


SMILES CC(C[C@@H]1C(=O)N[C@@H](C(=O)N1[C@H](c1ccc(cc1F)F)C(=O)NC(C)C)C1Cc2c(C1)cccc2)C
InChIKey QGSYCKKZFPLTMQ-UBFVSLLYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 497.2

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
OT OXYR Human Vasopressin and oxytocin A pKi 8.9 8.9 8.9 ChEMBL
V1A V1AR Human Vasopressin and oxytocin A pKi 5.2 5.2 5.2 ChEMBL
V2 V2R Human Vasopressin and oxytocin A pKi 6.2 6.2 6.2 ChEMBL
OT OXYR Human Vasopressin and oxytocin A pKi 8.9 8.9 8.9 Guide to Pharmacology
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database