General Information of the Compound
| Compound ID |
CP0512385
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| Compound Name |
3-{[7-(pyridin-2-yl)quinolin-4-yl]amino}phenol
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| Structure |
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| Formula |
C20H15N3O
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| Molecular Weight |
313.36
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| Canonical SMILES |
Oc1cccc(Nc2ccnc3cc(ccc23)-c2ccccn2)c1
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| InChI |
InChI=1S/C20H15N3O/c24-16-5-3-4-15(13-16)23-19-9-11-22-20-12-14(7-8-17(19)20)18-6-1-2-10-21-18/h1-13,24H,(H,22,23)
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| InChIKey |
LKEMSOXNBHSJTM-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