General Information of the Compound
| Compound ID |
CP0894042
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| Compound Name |
(3R)-3-(2-cyclopentyl-2-phenylpropanoyloxy)-1,1-dimethylpyrrolidinium bromide
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| Structure |
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| Formula |
C20H30BrNO2
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| Molecular Weight |
396.369
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| Canonical SMILES |
CC(C(=O)O[C@@H]1CC[N+](C)(C)C1)(c1ccccc1)C1CCCC1.[Br-]
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| InChI |
InChI=1S/C20H30NO2.BrH/c1-20(17-11-7-8-12-17,16-9-5-4-6-10-16)19(22)23-18-13-14-21(2,3)15-18;/h4-6,9-10,17-18H,7-8,11-15H2,1-3H3;1H/q+1;/p-1/t18-,20?;/m1./s1
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| InChIKey |
DDYMHKDAECHERK-HUVSLODASA-M
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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