COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK405036
Chemical Name: 6-methyl3-propyl2,7-dimethyl-4-(2-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Smiles: CCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1[N+](=O)[O-])C(=O)C(C(C2)C)C(=O)OC

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Molecular Weight: 442.47
Empirical Formula: C23H26N2O7

Physical State: Dry powder
Available Amount: 165 mg

Lipinsky:
logP: 2.916
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 127
Number of rings: 3

     

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