General Information of the Compound
| Compound ID |
CP0474093
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| Compound Name |
5-(1-methylimidazol-4-yl)-2-[1-[(2S)-2-[4-(trifluoromethoxy)phenyl]propanoyl]piperidin-4-yl]oxybenzamide
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| Structure |
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| Formula |
C26H27F3N4O4
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| Molecular Weight |
516.52
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| Canonical SMILES |
C[C@H](C(=O)N1CCC(CC1)Oc1ccc(cc1C(N)=O)-c1cn(C)cn1)c1ccc(OC(F)(F)F)cc1
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| InChI |
InChI=1S/C26H27F3N4O4/c1-16(17-3-6-20(7-4-17)37-26(27,28)29)25(35)33-11-9-19(10-12-33)36-23-8-5-18(13-21(23)24(30)34)22-14-32(2)15-31-22/h3-8,13-16,19H,9-12H2,1-2H3,(H2,30,34)/t16-/m0/s1
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| InChIKey |
ODHHGNXLHJYSLD-INIZCTEOSA-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