COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK733128
Chemical Name: (2E)-3-(4-nitrophenyl)-N-[2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)ethyl]prop-2-enamide
Smiles: O=C(/C=C/c1ccc(cc1)[N+](=O)[O-])NCCN1Cc2c(C1=O)cccc2

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Molecular Weight: 351.36
Empirical Formula: C19H17N3O4

Physical State: Dry powder
Available Amount: 257 mg

Lipinsky:
logP: 1.558
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 3

     

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