COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK245666
Chemical Name: 3-({[(4-methyl-5-{2-[(2-methylphenyl)amino]-2-oxoethyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoicacid
Smiles: O=C(Nc1cccc(c1)C(=O)O)CSc1nnc(n1C)CC(=O)Nc1ccccc1C

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Molecular Weight: 439.5
Empirical Formula: C21H21N5O4S

Physical State: Dry powder
Available Amount: 133 mg

Lipinsky:
logP: 3.383
Rotatable bonds: 7
H-donors: 3
H-acceptors: 4
PSA: 151
Number of rings: 3

     

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