COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044083
Chemical Name: 5-(4-chlorophenyl)-4-{[(E)-(2,3,4-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1c(ccc(c1OC)OC)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)Cl

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Molecular Weight: 404.88
Empirical Formula: C18H17ClN4O3S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 2.89
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 99
Number of rings: 3

     

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