TC114 [511717]



TC114


SMILES CN(C(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C1CCN(c2nnc(-c3ccnn3C)c3ccccc23)CC1
InChIKey ZDEZQXNVPSUJHK-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors 8
Hydrogen bond donors 0
Rotatable bonds 5
Log P 4.698
Molecular weight (Da) 539.2
Stereochemistry info unspecified

Database connections

Structure pdb 5V57 5V56

No bioactivity data available.

TC114


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 5V57 5V56

Compound is not listed as a drug.