COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK574105
Chemical Name: dimethyl5-{[(5-hydroxy-7,7-dimethyl-2-oxo-2,3,4,6,7,8-hexahydroquinolin-4-yl)carbonyl]amino}benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(NC(=O)C2CC(=O)N=C3C2=C(O)CC(C3)(C)C)cc(c1)C(=O)OC

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Molecular Weight: 428.44
Empirical Formula: C22H24N2O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.337
Rotatable bonds: 6
H-donors: 2
H-acceptors: 7
PSA: 131
Number of rings: 3

     

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