COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK593964
Chemical Name: 5-(3,4,5-trimethoxyphenyl)-4-{[(E)-(2,4,5-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(OC)c(cc1/C=N/n1c(=S)[nH]nc1c1cc(OC)c(c(c1)OC)OC)OC

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Molecular Weight: 460.51
Empirical Formula: C21H24N4O6S

Physical State: Dry powder
Available Amount: 153 mg

Lipinsky:
logP: 1.878
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 127
Number of rings: 3

     

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