COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK013697
Chemical Name: methyl4-{(E)-[2-({[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1c1ccccc1)c1ccc(c(c1)OC)OC

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Molecular Weight: 531.59
Empirical Formula: C27H25N5O5S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 7.601
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 142
Number of rings: 4

     

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