General Information of the Compound
| Compound ID |
CP0425263
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| Compound Name |
[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl] N-(4-propan-2-ylphenyl)carbamate
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| Formula |
C24H30N2O2
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| Molecular Weight |
378.516
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| Canonical SMILES |
CC(C)c1ccc(NC(=O)OC2CCN(CC2)C2Cc3ccccc3C2)cc1
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| InChI |
InChI=1S/C24H30N2O2/c1-17(2)18-7-9-21(10-8-18)25-24(27)28-23-11-13-26(14-12-23)22-15-19-5-3-4-6-20(19)16-22/h3-10,17,22-23H,11-16H2,1-2H3,(H,25,27)
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| InChIKey |
CDBAAXNYHDKTFF-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