General Information of the Compound
| Compound ID |
CP0551898
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| Compound Name |
6-chloro-N-[(4,4-difluorocyclohexyl)methyl]-2-(2-hydroxyethylamino)quinoline-5-carboxamide
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| Structure |
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| Formula |
C19H22ClF2N3O2
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| Molecular Weight |
397.853
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| Canonical SMILES |
OCCNc1ccc2c(C(=O)NCC3CCC(F)(F)CC3)c(Cl)ccc2n1
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| InChI |
InChI=1S/C19H22ClF2N3O2/c20-14-2-3-15-13(1-4-16(25-15)23-9-10-26)17(14)18(27)24-11-12-5-7-19(21,22)8-6-12/h1-4,12,26H,5-11H2,(H,23,25)(H,24,27)
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| InChIKey |
LKOLPIPFWSTMAO-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