COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK140044
Chemical Name: 3-[({[5-({[(2-chlorophenyl)carbonyl]amino}methyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: CCn1c(SCC(=O)Nc2cccc(c2)C(=O)O)nnc1CNC(=O)c1ccccc1Cl

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Molecular Weight: 473.94
Empirical Formula: C21H20ClN5O4S

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 3.405
Rotatable bonds: 9
H-donors: 3
H-acceptors: 4
PSA: 151
Number of rings: 3

     

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