COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK009594
Chemical Name: N-{(1E)-1-(1,3-benzodioxol-5-yl)-3-[(2E)-2-(3-iodo-4,5-dimethoxybenzylidene)hydrazinyl]-3-oxoprop-1-en-2-yl}benzamide
Smiles: COc1c(I)cc(cc1OC)/C=N/NC(=O)/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1

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Molecular Weight: 599.38
Empirical Formula: C26H22IN3O6

Physical State: Dry powder
Available Amount: 259 mg

Lipinsky:
logP: 6.579
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 107
Number of rings: 4

     

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