General Information of the Compound
| Compound ID |
CP0059010
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| Compound Name |
(8R)-8-[3-fluoro-4-(trifluoromethyl)phenyl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-1,7-naphthyridine-7-carboxamide
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| Structure |
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| Formula |
C19H16F7N3O
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| Molecular Weight |
435.343
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| Canonical SMILES |
C[C@H](NC(=O)N1CCc2cccnc2[C@H]1c1ccc(c(F)c1)C(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C19H16F7N3O/c1-10(18(21,22)23)28-17(30)29-8-6-11-3-2-7-27-15(11)16(29)12-4-5-13(14(20)9-12)19(24,25)26/h2-5,7,9-10,16H,6,8H2,1H3,(H,28,30)/t10-,16+/m0/s1
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| InChIKey |
BFQHDZVFGYDEMD-MGPLVRAMSA-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