General Information of the Compound
| Compound ID |
CP0930968
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| Compound Name |
5-(4-(2,4-difluorophenoxy)piperidin-1-yl)-4-(4-methoxynicotinamido)-N,N-dimethylpicolinamide
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| Structure |
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| Formula |
C26H27F2N5O4
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| Molecular Weight |
511.529
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| Canonical SMILES |
COc1ccncc1C(=O)Nc1cc(C(=O)N(C)C)ncc1N1CCC(Oc2ccc(F)cc2F)CC1
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| InChI |
InChI=1S/C26H27F2N5O4/c1-32(2)26(35)21-13-20(31-25(34)18-14-29-9-6-23(18)36-3)22(15-30-21)33-10-7-17(8-11-33)37-24-5-4-16(27)12-19(24)28/h4-6,9,12-15,17H,7-8,10-11H2,1-3H3,(H,30,31,34)
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| InChIKey |
GEQASCNBJJHNMW-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