General Information of the Compound
| Compound ID |
CP0421442
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| Compound Name |
4-[4-(2-tert-butylpyrazol-3-yl)phenoxy]furo[3,2-c]pyridine
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| Structure |
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| Formula |
C20H19N3O2
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| Molecular Weight |
333.391
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| Canonical SMILES |
CC(C)(C)n1nccc1-c1ccc(Oc2nccc3occc23)cc1
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| InChI |
InChI=1S/C20H19N3O2/c1-20(2,3)23-17(8-12-22-23)14-4-6-15(7-5-14)25-19-16-10-13-24-18(16)9-11-21-19/h4-13H,1-3H3
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| InChIKey |
VEXDLNHCJCAYRH-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