General Information of the Compound
| Compound ID |
CP0483908
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| Compound Name |
US9428456, 2.003
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| Structure |
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| Formula |
C23H28ClN3O2
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| Molecular Weight |
413.949
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| Canonical SMILES |
CC(C)NC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1
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| InChI |
InChI=1S/C23H28ClN3O2/c1-16(2)25-22(28)19-10-12-27(13-11-19)15-17-4-3-5-21(14-17)26-23(29)18-6-8-20(24)9-7-18/h3-9,14,16,19H,10-13,15H2,1-2H3,(H,25,28)(H,26,29)
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| InChIKey |
GKCFGLBUEJGUOQ-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