General Information of the Compound
| Compound ID |
CP0405988
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| Compound Name |
2-(3-chlorophenyl)-6-fluoro-N-[[(3S,4R)-3-fluoropiperidin-4-yl]methyl]benzamide
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| Structure |
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| Formula |
C19H19ClF2N2O
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| Molecular Weight |
364.823
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| Canonical SMILES |
F[C@@H]1CNCC[C@@H]1CNC(=O)c1c(F)cccc1-c1cccc(Cl)c1
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| InChI |
InChI=1S/C19H19ClF2N2O/c20-14-4-1-3-12(9-14)15-5-2-6-16(21)18(15)19(25)24-10-13-7-8-23-11-17(13)22/h1-6,9,13,17,23H,7-8,10-11H2,(H,24,25)/t13-,17-/m1/s1
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| InChIKey |
JGFRSSUKDACYEW-CXAGYDPISA-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: PT01266, Muscarinic acetylcholine receptor M3