COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK098407
Chemical Name: 2-methylpropyl4-(2,5-dimethoxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COc1ccc(c(c1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1cccs1)C(=O)OCC(C)C)OC

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Molecular Weight: 481.61
Empirical Formula: C27H31NO5S

Physical State: Dry powder
Available Amount: 200 mg

Lipinsky:
logP: 4.277
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 102
Number of rings: 4

     

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