General Information of the Compound
| Compound ID |
CP0864660
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| Compound Name |
(R)-3-(9-hydroxy-9H-fluorene-9-carboxamido)-1-(3-(methyl(phenyl)amino)propyl)-1-azoniabicyclo[2.2.2]octane chloride
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| Structure |
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| Formula |
C31H36ClN3O2
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| Molecular Weight |
518.101
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| Canonical SMILES |
CN(CCC[N+]12CCC(CC1)[C@@H](NC(=O)C1(O)c3ccccc3-c3ccccc31)C2)c1ccccc1.[Cl-]
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| InChI |
InChI=1S/C31H35N3O2.ClH/c1-33(24-10-3-2-4-11-24)18-9-19-34-20-16-23(17-21-34)29(22-34)32-30(35)31(36)27-14-7-5-12-25(27)26-13-6-8-15-28(26)31;/h2-8,10-15,23,29,36H,9,16-22H2,1H3;1H/t23?,29-,34?;/m0./s1
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| InChIKey |
OLPZDLPPXQWQNY-STNBFCITSA-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