General Information of the Compound
| Compound ID |
CP0398502
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| Compound Name |
N-[3-ethoxy-5-(4-fluorophenoxy)phenyl]-4-(2-ethylbutyl)-4-hydroxypiperidine-1-carboxamide
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| Structure |
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| Formula |
C26H35FN2O4
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| Molecular Weight |
458.574
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| Canonical SMILES |
CCOc1cc(NC(=O)N2CCC(O)(CC(CC)CC)CC2)cc(Oc2ccc(F)cc2)c1
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| InChI |
InChI=1S/C26H35FN2O4/c1-4-19(5-2)18-26(31)11-13-29(14-12-26)25(30)28-21-15-23(32-6-3)17-24(16-21)33-22-9-7-20(27)8-10-22/h7-10,15-17,19,31H,4-6,11-14,18H2,1-3H3,(H,28,30)
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| InChIKey |
KGTVMJWJRLDBFD-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