General Information of the Compound
| Compound ID |
CP0949873
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| Compound Name |
1-(2-(4-(2-methoxyethyl)piperazin-1-yl)-2-phenylethyl)-N-methylpiperidine-4-carboxamide
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| Structure |
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| Formula |
C22H36N4O2
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| Molecular Weight |
388.556
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| Canonical SMILES |
CNC(=O)C1CCN(CC(c2ccccc2)N2CCN(CCOC)CC2)CC1
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| InChI |
InChI=1S/C22H36N4O2/c1-23-22(27)20-8-10-25(11-9-20)18-21(19-6-4-3-5-7-19)26-14-12-24(13-15-26)16-17-28-2/h3-7,20-21H,8-18H2,1-2H3,(H,23,27)
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| InChIKey |
XITVSNCRBUEUFF-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