General Information of the Compound
| Compound ID |
CP0452149
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| Compound Name |
4-((1H-Imidazol-4-yl)methyl)-1-(3-isopropylphenyl)piperidine
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| Structure |
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| Formula |
C18H25N3
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| Molecular Weight |
283.419
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| Canonical SMILES |
CC(C)c1cccc(c1)N1CCC(Cc2cnc[nH]2)CC1
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| InChI |
InChI=1S/C18H25N3/c1-14(2)16-4-3-5-18(11-16)21-8-6-15(7-9-21)10-17-12-19-13-20-17/h3-5,11-15H,6-10H2,1-2H3,(H,19,20)
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| InChIKey |
DCPNIDQZXCTZIV-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