COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK025989
Chemical Name: 2-{[5-(4-chlorophenyl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2C2CCCCC2)c2ccc(cc2)Cl)cc(c1O)OC

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Molecular Weight: 530.05
Empirical Formula: C25H28ClN5O4S

Physical State: Dry powder
Available Amount: 109 mg

Lipinsky:
logP: 6.974
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 136
Number of rings: 4

     

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