COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK293028
Chemical Name: ethyl2-chloro-5-[({[5-(2-hydroxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)C(=O)OCC)Cl)nnc1c1ccccc1O

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Molecular Weight: 472.95
Empirical Formula: C22H21ClN4O4S

Physical State: Dry powder
Available Amount: 178 mg

Lipinsky:
logP: 6.533
Rotatable bonds: 10
H-donors: 2
H-acceptors: 4
PSA: 131
Number of rings: 3

     

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