General Information of the Compound
| Compound ID |
CP0395297
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| Compound Name |
(Z)-N-[(Z)-3-methyl-5-thiophen-2-ylpent-2-en-4-ynoxy]-1-azabicyclo[2.2.1]heptan-3-imine
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| Structure |
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| Formula |
C16H18N2OS
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| Molecular Weight |
286.4
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| Canonical SMILES |
C\C(=C\CO\N=C1/CN2CCC1C2)C#Cc1cccs1
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| InChI |
InChI=1S/C16H18N2OS/c1-13(4-5-15-3-2-10-20-15)7-9-19-17-16-12-18-8-6-14(16)11-18/h2-3,7,10,14H,6,8-9,11-12H2,1H3/b13-7-,17-16+
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| InChIKey |
LRFVMXXZMDZDJC-RLUAEEPSSA-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