COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK087679
Chemical Name: cyclohexyl2,7,7-trimethyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COc1c(OC)cc(cc1OC)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCCC1

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Molecular Weight: 483.6
Empirical Formula: C28H37NO6

Physical State: Dry powder
Available Amount: 673 mg

Lipinsky:
logP: 4.175
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 83
Number of rings: 4

     

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