COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL335761
Chemical Name: 4-({(E)-[4-(diethylamino)phenyl]methylidene}amino)-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: CCN(c1ccc(cc1)/C=N/n1c(S)nnc1c1cc(OC)c(c(c1)OC)OC)CC

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Molecular Weight: 441.55
Empirical Formula: C22H27N5O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.254
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 112
Number of rings: 3

     

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