General Information of the Compound
| Compound ID |
CP0378965
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| Compound Name |
3-(1-octylpiperidin-4-yl)-1H-benzimidazol-2-one
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| Structure |
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| Formula |
C20H31N3O
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| Molecular Weight |
329.488
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| Canonical SMILES |
CCCCCCCCN1CCC(CC1)n1c2ccccc2[nH]c1=O
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| InChI |
InChI=1S/C20H31N3O/c1-2-3-4-5-6-9-14-22-15-12-17(13-16-22)23-19-11-8-7-10-18(19)21-20(23)24/h7-8,10-11,17H,2-6,9,12-16H2,1H3,(H,21,24)
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| InChIKey |
WWFWXCONORSQAA-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