General Information of the Compound
| Compound ID |
CP0403174
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| Compound Name |
N-(1-benzylpiperidin-4-yl)-5-bromo-3-methyl-1-benzofuran-2-carboxamide
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| Structure |
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| Formula |
C22H23BrN2O2
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| Molecular Weight |
427.342
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| Canonical SMILES |
Cc1c(oc2ccc(Br)cc12)C(=O)NC1CCN(Cc2ccccc2)CC1
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| InChI |
InChI=1S/C22H23BrN2O2/c1-15-19-13-17(23)7-8-20(19)27-21(15)22(26)24-18-9-11-25(12-10-18)14-16-5-3-2-4-6-16/h2-8,13,18H,9-12,14H2,1H3,(H,24,26)
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| InChIKey |
OMNOTFKMUOBUHW-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