COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK107074
Chemical Name: 4,4,6-trimethyl-1,2-dioxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl(2E)-3-(4-nitrophenyl)prop-2-enoate
Smiles: O=C(Oc1cc2C(=CC(N3c2c(c1)C(=O)C3=O)(C)C)C)/C=C/c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 418.41
Empirical Formula: C23H18N2O6

Physical State: Dry powder
Available Amount: 462 mg

Lipinsky:
logP: 4.093
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 109
Number of rings: 4

     

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