COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK287010
Chemical Name: (2Z)-2-(1H-benzimidazol-2-yl)-3-{4-[(4-methylphenyl)sulfanyl]-3-nitrophenyl}prop-2-enenitrile
Smiles: N#C/C(=C/c1ccc(c(c1)[N+](=O)[O-])Sc1ccc(cc1)C)/c1nc2c([nH]1)cccc2

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Molecular Weight: 412.47
Empirical Formula: C23H16N4O2S

Physical State: Dry powder
Available Amount: 119 mg

Lipinsky:
logP: 6.751
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 123
Number of rings: 4

     

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