COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK394971
Chemical Name: N-{(1E)-1-(1,3-benzodioxol-5-yl)-3-[(2E)-2-(2,4-dihydroxy-6-methylbenzylidene)hydrazinyl]-3-oxoprop-1-en-2-yl}benzamide
Smiles: Oc1cc(C)c(c(c1)O)/C=N/NC(=O)/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1

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Molecular Weight: 459.46
Empirical Formula: C25H21N3O6

Physical State: Dry powder
Available Amount: 180 mg

Lipinsky:
logP: 5.533
Rotatable bonds: 6
H-donors: 4
H-acceptors: 6
PSA: 129
Number of rings: 4

     

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