COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK777633
Chemical Name: dimethyl4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Smiles: COC(=O)C1C(CC2=C(C1=O)C(c1ccc3c(c1)OCO3)C(=C(N2)C)C(=O)OC)c1cccs1

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Molecular Weight: 481.53
Empirical Formula: C25H23NO7S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.987
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 128
Number of rings: 5

     

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