COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK372357
Chemical Name: benzyl4-[4-(dimethylamino)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CN(c1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OCc1ccccc1)C

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Molecular Weight: 444.57
Empirical Formula: C28H32N2O3

Available Amount: 0 mg

Lipinsky:
logP: 4.262
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 58
Number of rings: 4

     

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