General Information of the Compound
| Compound ID |
CP0063251
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| Compound Name |
cyclopropyl-[4-[[4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-6-methoxyquinolin-3-yl]methyl]piperazin-1-yl]methanone
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| Structure |
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| Formula |
C26H34N4O4
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| Molecular Weight |
466.582
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| Canonical SMILES |
COc1ccc2ncc(CN3CCN(CC3)C(=O)C3CC3)c(N3CCC4(CC3)OCCO4)c2c1
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| InChI |
InChI=1S/C26H34N4O4/c1-32-21-4-5-23-22(16-21)24(29-8-6-26(7-9-29)33-14-15-34-26)20(17-27-23)18-28-10-12-30(13-11-28)25(31)19-2-3-19/h4-5,16-17,19H,2-3,6-15,18H2,1H3
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| InChIKey |
JSWDZRRIXQFWQI-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