General Information of the Compound
| Compound ID |
CP0575424
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| Compound Name |
(3R,5R)-N-cyclopropyl-3-methyl-5-[8-(trifluoromethyl)quinolin-5-yl]piperidine-1-carboxamide
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| Structure |
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| Formula |
C20H22F3N3O
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| Molecular Weight |
377.41
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| Canonical SMILES |
C[C@@H]1C[C@@H](CN(C1)C(=O)NC1CC1)c1ccc(c2ncccc12)C(F)(F)F
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| InChI |
InChI=1S/C20H22F3N3O/c1-12-9-13(11-26(10-12)19(27)25-14-4-5-14)15-6-7-17(20(21,22)23)18-16(15)3-2-8-24-18/h2-3,6-8,12-14H,4-5,9-11H2,1H3,(H,25,27)/t12-,13+/m1/s1
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| InChIKey |
DBBWIDAPCWHNHG-OLZOCXBDSA-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