COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL196027
Chemical Name: (2Z)-2-cyano-3-(1,3-dimethyl-6-nitro-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)prop-2-enethioamide
Smiles: N#C/C(=C/c1cc2c(cc1[N+](=O)[O-])n(c(=O)n2C)C)/C(=S)N

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Molecular Weight: 317.33
Empirical Formula: C13H11N5O3S

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 0.714
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 151
Number of rings: 2

     

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