General Information of the Compound
| Compound ID |
CP0072062
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| Compound Name |
N-[4-(3-cyano-1-ethylindol-5-yl)oxyphenyl]-2-(methylamino)acetamide
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| Structure |
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| Formula |
C20H20N4O2
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| Molecular Weight |
348.406
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| Canonical SMILES |
CCn1cc(C#N)c2cc(Oc3ccc(NC(=O)CNC)cc3)ccc12
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| InChI |
InChI=1S/C20H20N4O2/c1-3-24-13-14(11-21)18-10-17(8-9-19(18)24)26-16-6-4-15(5-7-16)23-20(25)12-22-2/h4-10,13,22H,3,12H2,1-2H3,(H,23,25)
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| InChIKey |
FIPDFGXVCDUJQL-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