COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL362359
Chemical Name: 2-{[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]acetohydrazide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)N/N=C/C=C/c1ccccc1[N+](=O)[O-]

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Molecular Weight: 514.56
Empirical Formula: C26H22N6O4S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 7.034
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 152
Number of rings: 4

     

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