COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK404979
Chemical Name: 3-cyclohexyl6-methyl2,7-dimethyl-4-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Smiles: COC(=O)C1C(C)CC2=C(C1=O)C(c1ccc(cc1)C)C(=C(N2)C)C(=O)OC1CCCCC1

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Molecular Weight: 451.56
Empirical Formula: C27H33NO5

Physical State: Dry powder
Available Amount: 164 mg

Lipinsky:
logP: 4.643
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 81
Number of rings: 4

     

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