COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK569288
Chemical Name: methyl4-[(E)-{[3-(5-phenyl-1H-pyrazol-3-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/n1c(S)nnc1c1n[nH]c(c1)c1ccccc1

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Molecular Weight: 404.45
Empirical Formula: C20H16N6O2S

Physical State: Dry powder
Available Amount: 223 mg

Lipinsky:
logP: 5.046
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 136
Number of rings: 4

     

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