COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK029469
Chemical Name: N-{[6-chloro-2-(4-methylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-2-methyl-3-nitrobenzamide
Smiles: S=C(NC(=O)c1cccc(c1C)[N+](=O)[O-])Nc1cc2nn(nc2cc1Cl)c1ccc(cc1)C

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Molecular Weight: 480.93
Empirical Formula: C22H17ClN6O3S

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 6.012
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 149
Number of rings: 4

     

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