General Information of the Compound
| Compound ID |
CP0392021
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| Compound Name |
5-[(3S)-3-phenoxypyrrolidin-1-yl]-2,2-diphenylpentanamide
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| Structure |
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| Formula |
C27H30N2O2
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| Molecular Weight |
414.549
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| Canonical SMILES |
NC(=O)C(CCCN1CC[C@@H](C1)Oc1ccccc1)(c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C27H30N2O2/c28-26(30)27(22-11-4-1-5-12-22,23-13-6-2-7-14-23)18-10-19-29-20-17-25(21-29)31-24-15-8-3-9-16-24/h1-9,11-16,25H,10,17-21H2,(H2,28,30)/t25-/m0/s1
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| InChIKey |
XKGBDMVXPVMRSW-VWLOTQADSA-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: PT01198, Muscarinic acetylcholine receptor M2
Protein ID: PT01266, Muscarinic acetylcholine receptor M3