COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673522
Chemical Name: ethyl2-amino-4-(4-fluorophenyl)-7,7-dimethyl-1-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=C(N)N(c2cccc(c2)[N+](=O)[O-])C2=C(C1c1ccc(cc1)F)C(=O)CC(C2)(C)C

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Molecular Weight: 479.51
Empirical Formula: C26H26FN3O5

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: 3.722
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 118
Number of rings: 4

     

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