General Information of the Compound
| Compound ID |
CP0436000
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| Compound Name |
3-(1-(3-fluorobenzyl)-piperidin-4-yl)-5,5-di-(4-fluorophenyl)-imidazolidin-2-one
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| Structure |
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| Formula |
C27H26F3N3O
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| Molecular Weight |
465.519
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| Canonical SMILES |
Fc1ccc(cc1)C1(CN(C2CCN(Cc3cccc(F)c3)CC2)C(=O)N1)c1ccc(F)cc1
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| InChI |
InChI=1S/C27H26F3N3O/c28-22-8-4-20(5-9-22)27(21-6-10-23(29)11-7-21)18-33(26(34)31-27)25-12-14-32(15-13-25)17-19-2-1-3-24(30)16-19/h1-11,16,25H,12-15,17-18H2,(H,31,34)
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| InChIKey |
HWCBLDPYKRZMKJ-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: PT01198, Muscarinic acetylcholine receptor M2
Protein ID: PT01266, Muscarinic acetylcholine receptor M3