COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK024741
Chemical Name: 2-methylpropyl2-methyl-5-oxo-7-(thiophen-2-yl)-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COc1c(OC)cc(cc1OC)C1C(=C(C)NC2=C1C(=O)CC(C2)c1cccs1)C(=O)OCC(C)C

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Molecular Weight: 511.64
Empirical Formula: C28H33NO6S

Physical State: Dry powder
Available Amount: 200 mg

Lipinsky:
logP: 3.835
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 111
Number of rings: 4

     

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