General Information of the Compound
| Compound ID |
CP0930967
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| Compound Name |
N-(2-(4-(2,4-difluorophenoxy)piperidin-1-yl)-5-(dimethylcarbamoyl)phenyl)-2-methoxynicotinamide
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| Structure |
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| Formula |
C27H28F2N4O4
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| Molecular Weight |
510.541
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| Canonical SMILES |
COc1ncccc1C(=O)Nc1cc(C(=O)N(C)C)ccc1N1CCC(Oc2ccc(F)cc2F)CC1
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| InChI |
InChI=1S/C27H28F2N4O4/c1-32(2)27(35)17-6-8-23(22(15-17)31-25(34)20-5-4-12-30-26(20)36-3)33-13-10-19(11-14-33)37-24-9-7-18(28)16-21(24)29/h4-9,12,15-16,19H,10-11,13-14H2,1-3H3,(H,31,34)
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| InChIKey |
KXUKEETVRUKABG-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