COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK513869
Chemical Name: N-{(1E)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-[(2E)-2-(2,4,6-tribromo-3-hydroxybenzylidene)hydrazinyl]prop-1-en-2-yl}benzamide
Smiles: O=C(/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1)N/N=C/c1c(Br)cc(c(c1Br)O)Br

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Molecular Weight: 666.12
Empirical Formula: C24H16Br3N3O5

Physical State: Dry powder
Available Amount: 134 mg

Lipinsky:
logP: 8.142
Rotatable bonds: 4
H-donors: 3
H-acceptors: 5
PSA: 109
Number of rings: 4

     

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