COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK328682
Chemical Name: 4-[({[4-phenyl-5-(quinolin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: O=C(Nc1ccc(cc1)C(=O)O)CSc1nnc(n1c1ccccc1)c1ccc2c(n1)cccc2

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Molecular Weight: 481.53
Empirical Formula: C26H19N5O3S

Physical State: Dry powder
Available Amount: 229 mg

Lipinsky:
logP: 6.565
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 135
Number of rings: 5

     

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