COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK207060
Chemical Name: 2-(4,4-dimethyl-2,6-dioxocyclohexylidene)-4-hydroxy-7-(methoxycarbonyl)-2H-quinolin-1-ide
Smiles: COC(=O)c1ccc2c(c1)[N-]C(=C1C(=O)CC(CC1=O)(C)C)C=C2O

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Saltdata: Na+
Molecular Weight: 340.36
Empirical Formula: C19H18NO5

Physical State: Dry powder
Available Amount: 267 mg

Lipinsky:
logP: 1.446
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 80
Number of rings: 3

     

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