COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK233014
Chemical Name: 2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-nitrophenyl)ethanone
Smiles: Cc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 430.49
Empirical Formula: C23H18N4O3S

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 6.747
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 118
Number of rings: 4

     

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