TAK 044


SMILES CC(C[C@@H]1NC(=O)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](NC1=O)Cc1c[nH]c2c1cccc2)CC(=O)O)CC(=O)N1CCC(CC1)c1ccccc1)c1cccs1)C
InChIKey UOZMDLYHZJQAOO-YHIUFLQMSA-N
Sequence DDDXLW

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 9
Rotatable bonds 12
Molecular weight (Da) 926.4

Drug properties

Molecular type Peptide
Physiological/Surrogate Surrogate
Approved drug No

Database connections

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
ETB EDNRB Rat Endothelin A pA2 8.4 8.4 8.4 Guide to Pharmacology
ETA EDNRA Rat Endothelin A pA2 8.4 8.4 8.4 Guide to Pharmacology