General Information of the Compound
| Compound ID |
CP0400521
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| Compound Name |
4-((1H-Imidazol-4-yl)methyl)-1-(naphthalen-2-yl)piperidine
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| Structure |
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| Formula |
C19H21N3
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| Molecular Weight |
291.398
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| Canonical SMILES |
C(C1CCN(CC1)c1ccc2ccccc2c1)c1cnc[nH]1
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| InChI |
InChI=1S/C19H21N3/c1-2-4-17-12-19(6-5-16(17)3-1)22-9-7-15(8-10-22)11-18-13-20-14-21-18/h1-6,12-15H,7-11H2,(H,20,21)
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| InChIKey |
MLJCEASOBVFGME-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