General Information of the Compound
| Compound ID |
CP0240544
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| Compound Name |
cyclopropyl-[4-[4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-6,7-difluoroquinoline-3-carbonyl]piperazin-1-yl]methanone
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| Structure |
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| Formula |
C25H28F2N4O4
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| Molecular Weight |
486.519
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| Canonical SMILES |
Fc1cc2ncc(C(=O)N3CCN(CC3)C(=O)C3CC3)c(N3CCC4(CC3)OCCO4)c2cc1F
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| InChI |
InChI=1S/C25H28F2N4O4/c26-19-13-17-21(14-20(19)27)28-15-18(22(17)29-5-3-25(4-6-29)34-11-12-35-25)24(33)31-9-7-30(8-10-31)23(32)16-1-2-16/h13-16H,1-12H2
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| InChIKey |
DUAIQQKLZMRCAE-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