General Information of the Compound
| Compound ID |
CP0575179
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| Compound Name |
4-[7-methoxy-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 |
C30H27N5O5
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| Molecular Weight |
537.576
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| Canonical SMILES |
COc1cc2nccc(Oc3ccc(cc3)C(=O)Nc3ccccn3)c2cc1NC(=O)C#CCN1CCOCC1
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| InChI |
InChI=1S/C30H27N5O5/c1-38-27-20-24-23(19-25(27)33-29(36)6-4-14-35-15-17-39-18-16-35)26(11-13-31-24)40-22-9-7-21(8-10-22)30(37)34-28-5-2-3-12-32-28/h2-3,5,7-13,19-20H,14-18H2,1H3,(H,33,36)(H,32,34,37)
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| InChIKey |
VBABZDLFBGSOJV-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