General Information of the Compound
| Compound ID |
CP0514677
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| Compound Name |
N-(2-adamantyl)-1-benzylpiperidin-4-amine
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| Structure |
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| Formula |
C22H32N2
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| Molecular Weight |
324.512
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| Canonical SMILES |
C(N1CCC(CC1)NC1C2CC3CC(C2)CC1C3)c1ccccc1
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| InChI |
InChI=1S/C22H32N2/c1-2-4-16(5-3-1)15-24-8-6-21(7-9-24)23-22-19-11-17-10-18(13-19)14-20(22)12-17/h1-5,17-23H,6-15H2
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| InChIKey |
NPKWIBDFHNKRIF-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