COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK236307
Chemical Name: N-{(1Z)-1-(1,3-benzodioxol-5-yl)-3-[(2Z)-2-(3-nitrobenzylidene)hydrazinyl]-3-oxoprop-1-en-2-yl}benzamide
Smiles: O=C(/C(=C/c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1)N/N=C\c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 458.43
Empirical Formula: C24H18N4O6

Physical State: Dry powder
Available Amount: 399 mg

Lipinsky:
logP: 5.247
Rotatable bonds: 3
H-donors: 2
H-acceptors: 6
PSA: 134
Number of rings: 4

     

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