COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382020
Chemical Name: (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl(2Z)-3-(3-nitrophenyl)-2-{[(3-nitrophenyl)carbonyl]amino}prop-2-enoate
Smiles: O=C(/C(=C/c1cccc(c1)[N+](=O)[O-])/NC(=O)c1cccc(c1)[N+](=O)[O-])OCN1C(=O)c2c(C1=O)cccc2

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Molecular Weight: 516.42
Empirical Formula: C25H16N4O9

Physical State: Dry powder
Available Amount: 215 mg

Lipinsky:
logP: 4.032
Rotatable bonds: 5
H-donors: 1
H-acceptors: 9
PSA: 184
Number of rings: 4

     

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