General Information of the Compound
| Compound ID |
CP0904329
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| Compound Name |
4-[5-(3-Fluoropyridin-4-yl)-furo[2,3-c]pyridin-2-yl]piperidine-1-carboxylic acid tertbutyl ester
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| Structure |
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| Formula |
C22H24FN3O3
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| Molecular Weight |
397.45
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| Canonical SMILES |
CC(C)(C)OC(=O)N1CCC(c2cc3cc(-c4ccncc4F)ncc3o2)CC1
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| InChI |
InChI=1S/C22H24FN3O3/c1-22(2,3)29-21(27)26-8-5-14(6-9-26)19-11-15-10-18(25-13-20(15)28-19)16-4-7-24-12-17(16)23/h4,7,10-14H,5-6,8-9H2,1-3H3
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| InChIKey |
MJXOJGOUPXWJLB-UHFFFAOYSA-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