CHEMBL303274


SMILES CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)N2C(=O)OC[C@@H]2C)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCc3ccc(Cl)c(Cl)c3)C(=O)O[C@]12C
InChIKey PJFKNTBUDOJUIM-KCRUJQDRSA-N

Chemical properties

Hydrogen bond acceptors 14
Hydrogen bond donors 1
Rotatable bonds 11
Molecular weight (Da) 953.4

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
LH LSHR Rat Glycoprotein hormone A pKd 8.76 8.76 8.76 ChEMBL
GnRH1 GNRHR Rat Gonadotrophin-releasing hormone A pKi 9.17 9.19 9.2 ChEMBL
GnRH1 GNRHR Rat Gonadotrophin-releasing hormone A pKd 8.8 8.8 8.8 ChEMBL
GnRH1 GNRHR Human Gonadotrophin-releasing hormone A pKi 8.7 8.72 8.73 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database