General Information of the Compound
| Compound ID |
CP0043043
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| Compound Name |
(11S)-11-[methyl(2-phenylethyl)amino]pentacyclo[5.4.0.02,6.03,10.05,9]undecan-8-one
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| Structure |
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| Formula |
C20H23NO
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| Molecular Weight |
293.41
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| Canonical SMILES |
CN(CCc1ccccc1)[C@@H]1C2C3C4C2C(=O)C2C4CC3C12
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| InChI |
InChI=1S/C20H23NO/c1-21(8-7-10-5-3-2-4-6-10)19-15-11-9-12-14-13(11)17(19)18(14)20(22)16(12)15/h2-6,11-19H,7-9H2,1H3/t11?,12?,13?,14?,15?,16?,17?,18?,19-/m0/s1
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| InChIKey |
IDXFKHDXIHNWAI-RAOGCBAWSA-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