COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186934
Chemical Name: propan-2-yl3-[({[4-ethyl-5-(2-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCn1c(SCC(=O)Nc2cccc(c2)C(=O)OC(C)C)nnc1c1ccccc1F

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Molecular Weight: 442.51
Empirical Formula: C22H23FN4O3S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 5.288
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 111
Number of rings: 3

     

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