General Information of the Compound
Compound ID |
CP0357105
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Compound Name |
N-[(2R)-1-(4-fluoropiperidin-1-yl)propan-2-yl]-4-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]benzamide
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Formula |
C18H20F4N4O2
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Molecular Weight |
400.376
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Canonical SMILES |
C[C@H](CN1CCC(F)CC1)NC(=O)c1ccc(cc1)-c1noc(n1)C(F)(F)F
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InChI |
InChI=1S/C18H20F4N4O2/c1-11(10-26-8-6-14(19)7-9-26)23-16(27)13-4-2-12(3-5-13)15-24-17(28-25-15)18(20,21)22/h2-5,11,14H,6-10H2,1H3,(H,23,27)/t11-/m1/s1
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InChIKey |
FPSCUKUKYRNPDM-LLVKDONJSA-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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