COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK557581
Chemical Name: N'-[(E)-1,3-benzodioxol-5-ylmethylidene]-2-{[5-(3-nitrophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccccc1)c1cccc(c1)[N+](=O)[O-])N/N=C/c1ccc2c(c1)OCO2

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Molecular Weight: 502.51
Empirical Formula: C24H18N6O5S

Physical State: Dry powder
Available Amount: 259 mg

Lipinsky:
logP: 6.276
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 161
Number of rings: 5

     

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