General Information of the Compound
| Compound ID |
CP0503458
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| Compound Name |
4-(cyclohexylmethyl)-1-(3-imidazol-1-ylpropyl)triazole
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| Structure |
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| Formula |
C15H23N5
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| Molecular Weight |
273.384
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| Canonical SMILES |
C(Cn1ccnc1)Cn1cc(CC2CCCCC2)nn1
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| InChI |
InChI=1S/C15H23N5/c1-2-5-14(6-3-1)11-15-12-20(18-17-15)9-4-8-19-10-7-16-13-19/h7,10,12-14H,1-6,8-9,11H2
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| InChIKey |
URLZEOPFRQZBGW-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