General Information of the Compound
| Compound ID |
CP0457259
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| Compound Name |
[3-(2-fluoroethoxy)pyridin-2-yl]-[1-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperidin-4-yl]methanone
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| Structure |
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| Formula |
C23H27FN2O3
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| Molecular Weight |
398.478
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| Canonical SMILES |
O[C@@H]1Cc2ccccc2C[C@H]1N1CCC(CC1)C(=O)c1ncccc1OCCF
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| InChI |
InChI=1S/C23H27FN2O3/c24-9-13-29-21-6-3-10-25-22(21)23(28)16-7-11-26(12-8-16)19-14-17-4-1-2-5-18(17)15-20(19)27/h1-6,10,16,19-20,27H,7-9,11-15H2/t19-,20-/m1/s1
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| InChIKey |
OJZJJTRELXNKFW-WOJBJXKFSA-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