CHEMBL3747822



CHEMBL3747822


SMILES CCC(=O)NCCNC(=O)/N=C(/N)NCCC[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)NCc1ccc(O)cc1
InChIKey VQHNWOOVOKYJNL-HHHXNRCGSA-N

Chemical Properties

Hydrogen bond acceptors 5
Hydrogen bond donors 7
Rotatable bonds 15
Molecular weight (Da) 615.3

Database connections

Structure pdb 5ZBQ

Bioactivities

Receptor Activity Source
Protein Gene Species Family Class Type Min Avg Max Database
Receptor Activity Source
Protein Gene Species Family Class Type Min Avg Max Database

CHEMBL3747822


Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Clinical Trials

Phase I 0
Phase II 0
Phase III 0
Approved No

Database connections

Structure pdb 5ZBQ

Sankey plot

Compound is not listed as a drug.