General Information of the Compound
| Compound ID |
CP0902832
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| Compound Name |
(R)-N-Benzyl-2-(4-(3,5-difluorobenzoyl)piperazin-1-yl)-N-methyl-2-phenylacetamide
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| Structure |
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| Formula |
C27H27F2N3O2
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| Molecular Weight |
463.528
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| Canonical SMILES |
CN(Cc1ccccc1)C(=O)[C@@H](c1ccccc1)N1CCN(C(=O)c2cc(F)cc(F)c2)CC1
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| InChI |
InChI=1S/C27H27F2N3O2/c1-30(19-20-8-4-2-5-9-20)27(34)25(21-10-6-3-7-11-21)31-12-14-32(15-13-31)26(33)22-16-23(28)18-24(29)17-22/h2-11,16-18,25H,12-15,19H2,1H3/t25-/m1/s1
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| InChIKey |
ONXKSGKZNCJRSD-RUZDIDTESA-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
Protein ID: PT01105, Sodium channel protein type 5 subunit alpha
Protein ID: PT01000, Sodium channel protein type 9 subunit alpha