COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK366734
Chemical Name: ethyl4-(4-ethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOc1ccc(cc1)C1C2=C(NC(=C1C(=O)OCC)C)CC(CC2=O)(C)C

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Molecular Weight: 383.49
Empirical Formula: C23H29NO4

Physical State: Dry powder
Available Amount: 214 mg

Lipinsky:
logP: 3.654
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 64
Number of rings: 3

     

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