PD-135666


SMILES OC(=O)C[C@@H](NC(=O)[C@@](Cc1c[nH]c2c1cccc2)(NC(=O)OC1C2CC3CC1CC(C2)C3)C)Cc1ccccc1
InChIKey PGOLWKTUHWHYJS-SFMDGOMNSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 4
Rotatable bonds 10
Molecular weight (Da) 557.3

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
TRH1 TRHR Mouse Thyrotropin-releasing hormone A pKi 4.7 4.7 4.7 Guide to Pharmacology
TRH1 TRHR Rat Thyrotropin-releasing hormone A pKi 4.82 4.82 4.82 Guide to Pharmacology
H1 HRH1 Human Histamine A pKi 6.68 6.68 6.68 ChEMBL
TRH1 TRFR Human Thyrotropin-releasing hormone A pKi 8.18 8.18 8.18 Drug Central
TRH1 TRHR Mouse Thyrotropin-releasing hormone A pKi 8.33 8.33 8.33 Drug Central
TRH1 TRHR Rat Thyrotropin-releasing hormone A pKi 8.32 8.32 8.32 Drug Central
H1 HRH1 Human Histamine A pKi 8.18 8.18 8.18 Drug Central
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H1 HRH1 Human Histamine A pIC50 5.75 5.75 5.75 ChEMBL