General Information of the Compound
| Compound ID |
CP0563955
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| Compound Name |
2-(5-methoxy-1-prop-2-enylindol-3-yl)pyridine-3-carbonitrile
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| Structure |
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| Formula |
C18H15N3O
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| Molecular Weight |
289.338
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| Canonical SMILES |
COc1ccc2n(CC=C)cc(-c3ncccc3C#N)c2c1
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| InChI |
InChI=1S/C18H15N3O/c1-3-9-21-12-16(18-13(11-19)5-4-8-20-18)15-10-14(22-2)6-7-17(15)21/h3-8,10,12H,1,9H2,2H3
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| InChIKey |
JVSOCROBPDBANX-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