COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL061978
Chemical Name: 2-(4-nitrophenyl)-2-oxoethyl4-methyl-3-(4-methyl-1,3-dioxo-1,3-dihydro-2H-pyrrolo[3,4-c]quinolin-2-yl)benzoate
Smiles: O=C(c1ccc(c(c1)N1C(=O)c2c(C1=O)c(C)nc1c2cccc1)C)OCC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 509.47
Empirical Formula: C28H19N3O7

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 4.397
Rotatable bonds: 4
H-donors: 0
H-acceptors: 7
PSA: 139
Number of rings: 5

     

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