General Information of the Compound
| Compound ID |
CP0404732
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| Compound Name |
1-Aza-bicyclo[2.2.1]heptan-3-one O-((Z)-3-methyl-pent-2-en-4-ynyl)-oxime
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| Structure |
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| Formula |
C12H16N2O
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| Molecular Weight |
204.273
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| Canonical SMILES |
C\C(=C\CO\N=C1/CN2CCC1C2)C#C
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| InChI |
InChI=1S/C12H16N2O/c1-3-10(2)5-7-15-13-12-9-14-6-4-11(12)8-14/h1,5,11H,4,6-9H2,2H3/b10-5-,13-12+
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| InChIKey |
GUIAADODPXLDMB-FCHMPZTMSA-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