General Information of the Compound
| Compound ID |
CP0209979
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| Compound Name |
2-(4-(1H-pyrazol-1-yl)piperidin-1-yl)-1-(4-fluorobenzyl)-1H-benzo[d]imidazole
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| Structure |
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| Formula |
C22H22FN5
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| Molecular Weight |
375.451
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| Canonical SMILES |
Fc1ccc(Cn2c(nc3ccccc23)N2CCC(CC2)n2cccn2)cc1
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| InChI |
InChI=1S/C22H22FN5/c23-18-8-6-17(7-9-18)16-27-21-5-2-1-4-20(21)25-22(27)26-14-10-19(11-15-26)28-13-3-12-24-28/h1-9,12-13,19H,10-11,14-16H2
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| InChIKey |
SDEZSIUXMXPOCO-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: PT01206, Histamine H1 receptor
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2