General Information of the Compound
| Compound ID |
CP0575177
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| Compound Name |
4-[6-(but-2-ynoylamino)-7-(oxan-4-yloxy)quinolin-4-yl]oxy-N-pyridin-2-ylbenzamide
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| Structure |
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| Formula |
C30H26N4O5
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| Molecular Weight |
522.561
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| Canonical SMILES |
CC#CC(=O)Nc1cc2c(Oc3ccc(cc3)C(=O)Nc3ccccn3)ccnc2cc1OC1CCOCC1
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| InChI |
InChI=1S/C30H26N4O5/c1-2-5-29(35)33-25-18-23-24(19-27(25)39-22-12-16-37-17-13-22)31-15-11-26(23)38-21-9-7-20(8-10-21)30(36)34-28-6-3-4-14-32-28/h3-4,6-11,14-15,18-19,22H,12-13,16-17H2,1H3,(H,33,35)(H,32,34,36)
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| InChIKey |
GLHXUKWUPVVWIO-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