COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL004999
Chemical Name: 5-[4-(dimethylamino)phenyl]-4-{[(E)-(2,4,5-trimethoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(OC)c(cc1/C=N/n1c(S)nnc1c1ccc(cc1)N(C)C)OC

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Molecular Weight: 413.5
Empirical Formula: C20H23N5O3S

Available Amount: 0 mg

Lipinsky:
logP: 5.021
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 112
Number of rings: 3

     

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