General Information of the Compound
| Compound ID |
CP0505528
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| Compound Name |
5-{[7-(1-benzofuran-2-yl)quinolin-4-yl]amino}-2-bromophenol
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| Structure |
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| Formula |
C23H15BrN2O2
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| Molecular Weight |
431.289
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| Canonical SMILES |
Oc1cc(Nc2ccnc3cc(ccc23)-c2cc3ccccc3o2)ccc1Br
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| InChI |
InChI=1S/C23H15BrN2O2/c24-18-8-6-16(13-21(18)27)26-19-9-10-25-20-11-15(5-7-17(19)20)23-12-14-3-1-2-4-22(14)28-23/h1-13,27H,(H,25,26)
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| InChIKey |
SAPRCZLNSVETMH-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