General Information of the Compound
| Compound ID |
CP0503456
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| Compound Name |
1-[3-[4-(cyclohexylmethyl)triazol-1-yl]propyl]piperidine
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| Structure |
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| Formula |
C17H30N4
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| Molecular Weight |
290.455
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| Canonical SMILES |
C(CN1CCCCC1)Cn1cc(CC2CCCCC2)nn1
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| InChI |
InChI=1S/C17H30N4/c1-3-8-16(9-4-1)14-17-15-21(19-18-17)13-7-12-20-10-5-2-6-11-20/h15-16H,1-14H2
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| InChIKey |
OYMQULTUNYMDLK-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: PT01194, Histamine H3 receptor
Protein ID: PT01711, Histamine H4 receptor