CHEMBL6177228 [467499]



CHEMBL6177228


SMILES CC[C@@H](Nc1c(Nc2ccnc(C(=O)N(C)C)c2O)c(=O)c1=O)c1cc(C(C)C)co1
InChIKey JSZQMZJVSCVDMA-CYBMUJFWSA-N

Chemical Properties

Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 8
Log P 3.108
Molecular weight (Da) 426.2
Stereochemistry info full

Database connections

Structure pdb 9D3G 9D3E 6LFL

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

CHEMBL6177228


Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Distribution across phases (no. indications)

Phase I 0
Phase II 0
Phase III 0
Phase IV 0

Database connections

Structure pdb 9D3G 9D3E 6LFL

Compound is not listed as a drug.