General Information of the Compound
| Compound ID |
CP0426392
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| Compound Name |
4-[6-(4-morpholin-4-ylbut-2-ynoylamino)quinolin-4-yl]oxy-N-pyridin-2-ylbenzamide
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| Structure |
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| Formula |
C29H25N5O4
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| Molecular Weight |
507.55
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| Canonical SMILES |
O=C(Nc1ccc2nccc(Oc3ccc(cc3)C(=O)Nc3ccccn3)c2c1)C#CCN1CCOCC1
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| InChI |
InChI=1S/C29H25N5O4/c35-28(5-3-15-34-16-18-37-19-17-34)32-22-8-11-25-24(20-22)26(12-14-30-25)38-23-9-6-21(7-10-23)29(36)33-27-4-1-2-13-31-27/h1-2,4,6-14,20H,15-19H2,(H,32,35)(H,31,33,36)
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| InChIKey |
MXXWRLXWERZYNI-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