General Information of the Compound
| Compound ID |
CP0570281
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| Compound Name |
N-[6-[(1-cyclopropylpiperidin-4-ylidene)-fluoromethyl]pyridin-2-yl]-2,4,6-trifluorobenzamide
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| Structure |
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| Formula |
C21H19F4N3O
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| Molecular Weight |
405.395
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| Canonical SMILES |
FC(=C1CCN(CC1)C1CC1)c1cccc(NC(=O)c2c(F)cc(F)cc2F)n1
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| InChI |
InChI=1S/C21H19F4N3O/c22-13-10-15(23)19(16(24)11-13)21(29)27-18-3-1-2-17(26-18)20(25)12-6-8-28(9-7-12)14-4-5-14/h1-3,10-11,14H,4-9H2,(H,26,27,29)
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| InChIKey |
XIUXRPXVQMOGIP-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