General Information of the Compound
| Compound ID |
CP0450655
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| Compound Name |
1-(cyclopropylmethyl)-4-[4-(2-methylpyridin-3-yl)oxyphenyl]-2-oxopyridine-3-carbonitrile
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| Structure |
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| Formula |
C22H19N3O2
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| Molecular Weight |
357.413
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| Canonical SMILES |
Cc1ncccc1Oc1ccc(cc1)-c1ccn(CC2CC2)c(=O)c1C#N
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| InChI |
InChI=1S/C22H19N3O2/c1-15-21(3-2-11-24-15)27-18-8-6-17(7-9-18)19-10-12-25(14-16-4-5-16)22(26)20(19)13-23/h2-3,6-12,16H,4-5,14H2,1H3
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| InChIKey |
DBDYSIWJXHLNQQ-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