General Information of the Compound
| Compound ID |
CP0425264
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| Compound Name |
[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl] N-ethyl-N-methylcarbamate
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| Formula |
C18H26N2O2
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| Molecular Weight |
302.418
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| Canonical SMILES |
CCN(C)C(=O)OC1CCN(CC1)C1Cc2ccccc2C1
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| InChI |
InChI=1S/C18H26N2O2/c1-3-19(2)18(21)22-17-8-10-20(11-9-17)16-12-14-6-4-5-7-15(14)13-16/h4-7,16-17H,3,8-13H2,1-2H3
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| InChIKey |
SPLXSISVGSVPMH-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