General Information of the Compound
| Compound ID |
CP0541921
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| Compound Name |
4-(2-cyclohexylethyl)-1-[3-(1H-imidazol-5-yl)propyl]triazole
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| Structure |
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| Formula |
C16H25N5
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| Molecular Weight |
287.411
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| Canonical SMILES |
C(Cc1cnc[nH]1)Cn1cc(CCC2CCCCC2)nn1
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| InChI |
InChI=1S/C16H25N5/c1-2-5-14(6-3-1)8-9-16-12-21(20-19-16)10-4-7-15-11-17-13-18-15/h11-14H,1-10H2,(H,17,18)
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| InChIKey |
KXTUUFGXZCWFKF-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