General Information of the Compound
| Compound ID |
CP0553881
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| Compound Name |
6-chloro-1-(1-pyridin-2-ylpiperidin-4-yl)-3H-[1,2,4]triazolo[4,3-a]benzimidazole
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| Formula |
C18H17ClN6
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| Molecular Weight |
352.829
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| Canonical SMILES |
Clc1ccc2c(c1)nc1[nH]nc(C3CCN(CC3)c3ccccn3)n21
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| InChI |
InChI=1S/C18H17ClN6/c19-13-4-5-15-14(11-13)21-18-23-22-17(25(15)18)12-6-9-24(10-7-12)16-3-1-2-8-20-16/h1-5,8,11-12H,6-7,9-10H2,(H,21,23)
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| InChIKey |
GLYUGSLFCFIWKI-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