CHEMBL5399968 [387636]



CHEMBL5399968


SMILES C[C@@H]1C=C(c2c[nH]c3ncccc23)CNC1
InChIKey HNDPIXZRQWKEFZ-SECBINFHSA-N

Chemical Properties

Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 1
Log P 2.186
Molecular weight (Da) 213.1
Stereochemistry info full

Database connections

Structure pdb 7RAN

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

CHEMBL5399968


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 7RAN

Compound is not listed as a drug.