COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK373574
Chemical Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(C)NC2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2

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Molecular Weight: 308.34
Empirical Formula: C18H16N2O3

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 1.651
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 4

     

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