COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK683670
Chemical Name: diethyl5-oxo-2-propyl-7-(thiophen-2-yl)-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Smiles: CCOC(=O)C1=C(CCC)NC2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)C(C(C2)c1cccs1)C(=O)OCC

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Molecular Weight: 583.7
Empirical Formula: C31H37NO8S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.69
Rotatable bonds: 11
H-donors: 1
H-acceptors: 8
PSA: 137
Number of rings: 4

     

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