COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK058622
Chemical Name: 4-methoxy-N-{[2-(4-methylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3-nitrobenzamide
Smiles: COc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccc2c(c1)nn(n2)c1ccc(cc1)C

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Molecular Weight: 462.49
Empirical Formula: C22H18N6O4S

Physical State: Dry powder
Available Amount: 348 mg

Lipinsky:
logP: 5.077
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 158
Number of rings: 4

     

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