COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK096801
Chemical Name: (2E)-3-(4-chloro-3-nitrophenyl)-N-[6-methyl-2-(4-methylphenyl)-2H-benzotriazol-5-yl]prop-2-enamide
Smiles: O=C(Nc1cc2nn(nc2cc1C)c1ccc(cc1)C)/C=C/c1ccc(c(c1)[N+](=O)[O-])Cl

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Molecular Weight: 447.88
Empirical Formula: C23H18ClN5O3

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 6.729
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 105
Number of rings: 4

     

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