COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK767008
Chemical Name: 5-chloro-2-{[(5,6-dinitro-1H-benzimidazol-2-yl)methyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile
Smiles: N#Cc1c(SCc2nc3c([nH]2)cc(c(c3)[N+](=O)[O-])[N+](=O)[O-])nc(c(c1C)Cl)C

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Molecular Weight: 418.82
Empirical Formula: C16H11ClN6O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.859
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 182
Number of rings: 3

     

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