COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK731951
Chemical Name: 1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinoline-3-carboxylicacid
Smiles: C=CCn1c(cc2c(c1=O)cccc2)C(=O)O

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Molecular Weight: 229.24
Empirical Formula: C13H11NO3

Physical State: Dry powder
Available Amount: 292 mg

Lipinsky:
logP: 2.053
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 57
Number of rings: 2

     

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