COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK273892
Chemical Name: 3-({[(5-{2-[(2,4-dimethylphenyl)amino]-2-oxoethyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoicacid
Smiles: O=C(Nc1cccc(c1)C(=O)O)CSc1nnc(n1C)CC(=O)Nc1ccc(cc1C)C

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Molecular Weight: 453.52
Empirical Formula: C22H23N5O4S

Physical State: Dry powder
Available Amount: 134 mg

Lipinsky:
logP: 3.843
Rotatable bonds: 7
H-donors: 3
H-acceptors: 4
PSA: 151
Number of rings: 3

     

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