General Information of the Compound
| Compound ID |
CP0385708
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| Compound Name |
2-(2-amino-1-benzimidazolyl)-1-(4-methoxyphenyl)ethanone
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| Structure |
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| Formula |
C16H15N3O2
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| Molecular Weight |
281.315
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| Canonical SMILES |
COc1ccc(cc1)C(=O)Cn1c(N)nc2ccccc12
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| InChI |
InChI=1S/C16H15N3O2/c1-21-12-8-6-11(7-9-12)15(20)10-19-14-5-3-2-4-13(14)18-16(19)17/h2-9H,10H2,1H3,(H2,17,18)
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| InChIKey |
JBKFSGHVUVRVBG-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: PT01446, Interleukin-8
Protein ID: PT03645, Nucleotide-binding oligomerization domain-containing protein 1
Protein ID: PT03970, Nucleotide-binding oligomerization domain-containing protein 2