4-(n-propyl)amino-3-nitrobenzoic acid [247]



4-(n-propyl)amino-3-nitrobenzoic acid


SMILES CCCNc1ccc(C(=O)O)cc1[N+](=O)[O-]
InChIKey OVDGUTHABMXVMI-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 5
Log P 2.115
Molecular weight (Da) 224.1
Stereochemistry info unspecified

Database connections

Structure pdb 8JEI

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

4-(n-propyl)amino-3-nitrobenzoic acid


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 8JEI

Compound is not listed as a drug.