General Information of the Compound
| Compound ID |
CP0908911
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| Compound Name |
[18F]-(1R,2S,3S,5S)-3-(4-chlorophenyl)-8-(3-fluoropropyl)-N,N-dimethyl-8-azabicyclo[3.2.1]octane-2-carboxamide
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| Structure |
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| Formula |
C19H26ClFN2O
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| Molecular Weight |
351.883938
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| Canonical SMILES |
CN(C)C(=O)[C@H]1[C@@H](c2ccc(Cl)cc2)C[C@@H]2CC[C@H]1N2CCC[18F]
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| InChI |
InChI=1S/C19H26ClFN2O/c1-22(2)19(24)18-16(13-4-6-14(20)7-5-13)12-15-8-9-17(18)23(15)11-3-10-21/h4-7,15-18H,3,8-12H2,1-2H3/t15-,16+,17+,18-/m0/s1/i21-1
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| InChIKey |
IZOYCGRRBKQLEO-AYBRLQTHSA-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