COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK016805
Chemical Name: N-{(1E)-1-(1,3-benzodioxol-5-yl)-3-[(2E)-2-(5-hydroxy-2-nitrobenzylidene)hydrazinyl]-3-oxoprop-1-en-2-yl}benzamide
Smiles: Oc1ccc(c(c1)/C=N/NC(=O)/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1)[N+](=O)[O-]

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Molecular Weight: 474.43
Empirical Formula: C24H18N4O7

Physical State: Dry powder
Available Amount: 374 mg

Lipinsky:
logP: 5.406
Rotatable bonds: 4
H-donors: 3
H-acceptors: 7
PSA: 155
Number of rings: 4

     

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