COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK996863
Chemical Name: 5-(3,4-dimethoxyphenyl)-4-{[(E)-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1OC)c1nnc(n1/N=C/c1c(C)nn(c1C)c1ccccc1)S

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Molecular Weight: 434.52
Empirical Formula: C22H22N6O2S

Available Amount: 0 mg

Lipinsky:
logP: 6.307
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 118
Number of rings: 4

     

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