General Information of the Compound
| Compound ID |
CP0562347
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| Compound Name |
9-[6-(5-fluoro-6-methoxypyridin-3-yl)-4-methylquinazolin-8-yl]oxy-N-hydroxynonanamide
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| Structure |
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| Formula |
C24H29FN4O4
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| Molecular Weight |
456.518
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| Canonical SMILES |
COc1ncc(cc1F)-c1cc(OCCCCCCCCC(=O)NO)c2ncnc(C)c2c1
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| InChI |
InChI=1S/C24H29FN4O4/c1-16-19-11-17(18-12-20(25)24(32-2)26-14-18)13-21(23(19)28-15-27-16)33-10-8-6-4-3-5-7-9-22(30)29-31/h11-15,31H,3-10H2,1-2H3,(H,29,30)
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| InChIKey |
XFPIUQQACYNBNB-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