COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK575428
Chemical Name: 4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-5-[4-(dimethylamino)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1c(cccc1OC)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)N(C)C

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Molecular Weight: 383.47
Empirical Formula: C19H21N5O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.493
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 93
Number of rings: 3

     

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