General Information of the Compound
| Compound ID |
CP0873693
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| Compound Name |
rac-5-(3-(1-(2-hydroxyethylamino)-2,3-dihydro-1H-inden-4-yl)-1,2,4-oxadiazol-5-yl)-2-(2-methoxyethoxy)benzonitrile
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| Structure |
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| Formula |
C23H24N4O4
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| Molecular Weight |
420.469
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| Canonical SMILES |
COCCOc1ccc(-c2nc(-c3cccc4c3CCC4NCCO)no2)cc1C#N
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| InChI |
InChI=1S/C23H24N4O4/c1-29-11-12-30-21-8-5-15(13-16(21)14-24)23-26-22(27-31-23)19-4-2-3-18-17(19)6-7-20(18)25-9-10-28/h2-5,8,13,20,25,28H,6-7,9-12H2,1H3
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| InChIKey |
NVIDYKGDESKLSH-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