COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL025104
Chemical Name: 2-{[4-(2,4-dimethylphenyl)-5-(2-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methyl-3-nitrophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)[N+](=O)[O-])C)CSc1nnc(n1c1ccc(cc1C)C)c1ccccc1O

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Molecular Weight: 489.55
Empirical Formula: C25H23N5O4S

Available Amount: 0 mg

Lipinsky:
logP: 8.096
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 151
Number of rings: 4

     

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