General Information of the Compound
| Compound ID |
CP0910701
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| Compound Name |
(1R,5R,9R)-9-((S)-1-methoxy-1-oxo-3-phenylpropan-2-ylcarbamoyl)-2-azoniabicyclo[3.3.1]nonane chloride
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| Formula |
C19H27ClN2O3
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| Molecular Weight |
366.889
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| Canonical SMILES |
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1[C@H]2CCC[C@@H]1NCC2.Cl
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| InChI |
InChI=1S/C19H26N2O3.ClH/c1-24-19(23)16(12-13-6-3-2-4-7-13)21-18(22)17-14-8-5-9-15(17)20-11-10-14;/h2-4,6-7,14-17,20H,5,8-12H2,1H3,(H,21,22);1H/t14-,15-,16-,17+;/m0./s1
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| InChIKey |
UKTLAXPYWJKDME-ZZKBWWPYSA-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