COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK776125
Chemical Name: dimethyl2-methyl-4-(2-methylphenyl)-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Smiles: COC(=O)C1C(=O)C2=C(CC1c1cccs1)NC(=C(C2c1ccccc1C)C(=O)OC)C

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Molecular Weight: 451.54
Empirical Formula: C25H25NO5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.585
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 109
Number of rings: 4

     

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