General Information of the Compound
| Compound ID |
CP0244384
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| Compound Name |
2-[(3-pyrimidin-4-ylbenzimidazol-5-yl)oxymethyl]quinoline
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| Structure |
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| Formula |
C21H15N5O
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| Molecular Weight |
353.385
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| Canonical SMILES |
C(Oc1ccc2ncn(-c3ccncn3)c2c1)c1ccc2ccccc2n1
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| InChI |
InChI=1S/C21H15N5O/c1-2-4-18-15(3-1)5-6-16(25-18)12-27-17-7-8-19-20(11-17)26(14-24-19)21-9-10-22-13-23-21/h1-11,13-14H,12H2
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| InChIKey |
NRDAQXSEPMKYFE-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