COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK114130
Chemical Name: 2-[(2-chloro-6-methoxy-4-{(E)-[(3-phenyl-5-sulfanyl-4H-1,2,4-triazol-4-yl)imino]methyl}phenoxy)methyl]benzonitrile
Smiles: COc1cc(/C=N/n2c(S)nnc2c2ccccc2)cc(c1OCc1ccccc1C#N)Cl

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Molecular Weight: 475.96
Empirical Formula: C24H18ClN5O2S

Physical State: Dry powder
Available Amount: 129 mg

Lipinsky:
logP: 7.018
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 124
Number of rings: 4

     

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