General Information of the Compound
| Compound ID |
CP0537074
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| Compound Name |
N-[(3S,4S)-1-cyclohexyl-3-(2-hydroxyethylcarbamoyl)piperidin-4-yl]-5-(2,4-difluorophenyl)-1,2-oxazole-3-carboxamide
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| Formula |
C24H30F2N4O4
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| Molecular Weight |
476.524
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| Canonical SMILES |
OCCNC(=O)[C@H]1CN(CC[C@@H]1NC(=O)c1cc(on1)-c1ccc(F)cc1F)C1CCCCC1
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| InChI |
InChI=1S/C24H30F2N4O4/c25-15-6-7-17(19(26)12-15)22-13-21(29-34-22)24(33)28-20-8-10-30(16-4-2-1-3-5-16)14-18(20)23(32)27-9-11-31/h6-7,12-13,16,18,20,31H,1-5,8-11,14H2,(H,27,32)(H,28,33)/t18-,20-/m0/s1
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| InChIKey |
TYGAMKUVSZBJPM-ICSRJNTNSA-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