COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK069725
Chemical Name: tetrahydrofuran-2-ylmethyl7-(2-methoxyphenyl)-2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COc1ccccc1C1CC(=O)C2=C(C1)NC(=C(C2c1cccc(c1)[N+](=O)[O-])C(=O)OCC1CCCO1)C

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Molecular Weight: 518.57
Empirical Formula: C29H30N2O7

Physical State: Dry powder
Available Amount: 252 mg

Lipinsky:
logP: 2.988
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 119
Number of rings: 5

     

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