General Information of the Compound
| Compound ID |
CP0549670
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| Compound Name |
(1-prop-2-ynylpiperidin-3-yl)methanol
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| Structure |
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| Formula |
C9H15NO
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| Molecular Weight |
153.225
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| Canonical SMILES |
OCC1CCCN(CC#C)C1
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| InChI |
InChI=1S/C9H15NO/c1-2-5-10-6-3-4-9(7-10)8-11/h1,9,11H,3-8H2
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| InChIKey |
SEGPGNSXCVPIKQ-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT00918, Amine oxidase [flavin-containing] A
Protein ID: PT01362, Amine oxidase [flavin-containing] B