General Information of the Compound
| Compound ID |
CP0895818
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| Compound Name |
1-(2-(piperidin-1-yl)ethyl)-2-(tetrahydrofuran-2-yl)-1H-pyrrolo[2,3-b]pyridine
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| Structure |
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| Formula |
C18H25N3O
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| Molecular Weight |
299.418
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| Canonical SMILES |
c1cnc2c(c1)cc([C@@H]1CCCO1)n2CCN1CCCCC1
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| InChI |
InChI=1S/C18H25N3O/c1-2-9-20(10-3-1)11-12-21-16(17-7-5-13-22-17)14-15-6-4-8-19-18(15)21/h4,6,8,14,17H,1-3,5,7,9-13H2/t17-/m0/s1
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| InChIKey |
QUROTGLADLKIIK-KRWDZBQOSA-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