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Chem Quinaldine Pacific | Cheminformatics

Quinaldine


  • SKU Code: CH139095
Chemical Name - Quinaldine
Mol Weight - 143.188
Smiles - Cc1nc2ccccc2cc1
Property Name Property Value
Mol NameQuinaldine
Molweight143.188
Monoisotopic Mass143.073499
Clogp2.3735
Clogs-2.69
H Acceptors1
Total Surface Area118.88
Relative Psa0.092278
Polar Surface Area12.89
Druglikeness-1.995
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritanthigh
Shape Index0.63636
Molecular Complexity0.64864
Fragments1
Non H Atoms11
Non Ch Atoms1
Electronegative Atoms1
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms10
Sp3 Atoms1
Aromatic Nitrogens1
SmilesCc1nc2ccccc2cc1
InChIKeyInChI=1S/C10H9N/c1-8-6-7-9-4-2-3-5-10(9)11-8/h2-7H,1H3
InChISMUQFGGVLNAIOZ-UHFFFAOYSA-N

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1 - Quinaldine
2 - Quinaldine
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