General Information of the Compound
| Compound ID |
CP0560044
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| Compound Name |
4-[6-(5-morpholin-4-ylpent-2-ynoylamino)quinolin-4-yl]oxy-N-pyridin-2-ylbenzamide
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| Structure |
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| Formula |
C30H27N5O4
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| Molecular Weight |
521.577
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| Canonical SMILES |
O=C(Nc1ccc2nccc(Oc3ccc(cc3)C(=O)Nc3ccccn3)c2c1)C#CCCN1CCOCC1
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| InChI |
InChI=1S/C30H27N5O4/c36-29(6-2-4-16-35-17-19-38-20-18-35)33-23-9-12-26-25(21-23)27(13-15-31-26)39-24-10-7-22(8-11-24)30(37)34-28-5-1-3-14-32-28/h1,3,5,7-15,21H,4,16-20H2,(H,33,36)(H,32,34,37)
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| InChIKey |
NGIXWKSQNJFMBI-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