General Information of the Compound
| Compound ID |
CP0404348
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| Compound Name |
(R)-1-(4-Aminomethyl-piperidin-1-yl)-2-cyclopentyl-2-hydroxy-2-phenyl-ethanone
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| Structure |
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| Formula |
C19H28N2O2
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| Molecular Weight |
316.445
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| Canonical SMILES |
NCC1CCN(CC1)C(=O)[C@@](O)(C1CCCC1)c1ccccc1
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| InChI |
InChI=1S/C19H28N2O2/c20-14-15-10-12-21(13-11-15)18(22)19(23,17-8-4-5-9-17)16-6-2-1-3-7-16/h1-3,6-7,15,17,23H,4-5,8-14,20H2/t19-/m0/s1
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| InChIKey |
OWDSSIDYHAEOHU-IBGZPJMESA-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