COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK508597
Chemical Name: 2,2,4-trimethyl-1-[(4-nitrophenyl)carbonyl]-1,2-dihydroquinolin-6-yl4-nitrobenzoate
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])Oc1ccc2c(c1)C(=CC(N2C(=O)c1ccc(cc1)[N+](=O)[O-])(C)C)C

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Molecular Weight: 487.47
Empirical Formula: C26H21N3O7

Physical State: Dry powder
Available Amount: 323 mg

Lipinsky:
logP: 5.697
Rotatable bonds: 2
H-donors: 0
H-acceptors: 7
PSA: 138
Number of rings: 4

     

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