COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382019
Chemical Name: (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl(2Z)-3-(4-chlorophenyl)-2-{[(3-nitrophenyl)carbonyl]amino}prop-2-enoate
Smiles: Clc1ccc(cc1)/C=C(/C(=O)OCN1C(=O)c2c(C1=O)cccc2)\NC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 505.87
Empirical Formula: C25H16ClN3O7

Physical State: Dry powder
Available Amount: 202 mg

Lipinsky:
logP: 4.656
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 138
Number of rings: 4

     

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