COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK767014
Chemical Name: 5-chloro-4,6-dimethyl-2-[(4-nitrobenzyl)sulfanyl]pyridine-3-carbonitrile
Smiles: N#Cc1c(SCc2ccc(cc2)[N+](=O)[O-])nc(c(c1C)Cl)C

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Molecular Weight: 333.8
Empirical Formula: C15H12ClN3O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.804
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 107
Number of rings: 2

     

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