General Information of the Compound
| Compound ID |
CP0355003
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| Compound Name |
2-[(6-methoxy-3-phenyl-2-propan-2-ylbenzimidazol-5-yl)oxymethyl]quinoline
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| Structure |
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| Formula |
C27H25N3O2
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| Molecular Weight |
423.516
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| Canonical SMILES |
COc1cc2nc(C(C)C)n(-c3ccccc3)c2cc1OCc1ccc2ccccc2n1
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| InChI |
InChI=1S/C27H25N3O2/c1-18(2)27-29-23-15-25(31-3)26(16-24(23)30(27)21-10-5-4-6-11-21)32-17-20-14-13-19-9-7-8-12-22(19)28-20/h4-16,18H,17H2,1-3H3
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| InChIKey |
YTYVYPAPXMLUQN-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