General Information of the Compound
| Compound ID |
CP0391237
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| Compound Name |
piperidin-4-ylmethyl N-[2-(4-cyanophenyl)-4-fluorophenyl]carbamate
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| Structure |
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| Formula |
C20H20FN3O2
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| Molecular Weight |
353.397
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| Canonical SMILES |
Fc1ccc(NC(=O)OCC2CCNCC2)c(c1)-c1ccc(cc1)C#N
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| InChI |
InChI=1S/C20H20FN3O2/c21-17-5-6-19(18(11-17)16-3-1-14(12-22)2-4-16)24-20(25)26-13-15-7-9-23-10-8-15/h1-6,11,15,23H,7-10,13H2,(H,24,25)
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| InChIKey |
CZIIEEAWXYVYOX-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
Protein ID: PT01310, Muscarinic acetylcholine receptor M1
Protein ID: PT01198, Muscarinic acetylcholine receptor M2
Protein ID: PT01266, Muscarinic acetylcholine receptor M3