COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416241
Chemical Name: methyl4-chloro-3-[({[5-(3,5-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COc1cc(OC)cc(c1)c1nnc([nH]1)SCC(=O)Nc1cc(ccc1Cl)C(=O)OC

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Molecular Weight: 462.91
Empirical Formula: C20H19ClN4O5S

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 4.506
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 140
Number of rings: 3

     

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