COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL393828
Chemical Name: methyl1-{[(4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-pyrazole-3-carboxylate
Smiles: COC(=O)c1ccn(n1)CSc1nncn1/N=C/c1ccc(c(c1)OC)OC

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Molecular Weight: 402.43
Empirical Formula: C17H18N6O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.497
Rotatable bonds: 9
H-donors: 0
H-acceptors: 4
PSA: 130
Number of rings: 3

     

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