COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK079280
Chemical Name: propan-2-yl2,7,7-trimethyl-5-oxo-4-(2,3,4-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COc1ccc(c(c1OC)OC)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC(C)C

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Molecular Weight: 443.54
Empirical Formula: C25H33NO6

Physical State: Dry powder
Available Amount: 444 mg

Lipinsky:
logP: 2.994
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 83
Number of rings: 3

     

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