General Information of the Compound
| Compound ID |
CP0920358
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| Compound Name |
(3-endo)-8-Methyl-3-(2,2,2-triphenylethyl)-8-azabicyclo[3.2.1]-octane
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| Formula |
C28H31N
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| Molecular Weight |
381.563
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| Canonical SMILES |
CN1[C@@H]2CC[C@H]1C[C@@H](CC(c1ccccc1)(c1ccccc1)c1ccccc1)C2
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| InChI |
InChI=1S/C28H31N/c1-29-26-17-18-27(29)20-22(19-26)21-28(23-11-5-2-6-12-23,24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-16,22,26-27H,17-21H2,1H3/t22-,26+,27-
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| InChIKey |
PILDZUGYLLHLSW-KNLYZUQLSA-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: PT01310, Muscarinic acetylcholine receptor M1
Protein ID: PT01198, Muscarinic acetylcholine receptor M2
Protein ID: PT01266, Muscarinic acetylcholine receptor M3