General Information of the Compound
| Compound ID |
CP0471454
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| Compound Name |
1-[3-[[4-(furan-2-ylmethylamino)quinazolin-2-yl]amino]phenyl]ethanol
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| Structure |
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| Formula |
C21H20N4O2
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| Molecular Weight |
360.417
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| Canonical SMILES |
CC(O)c1cccc(Nc2nc(NCc3ccco3)c3ccccc3n2)c1
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| InChI |
InChI=1S/C21H20N4O2/c1-14(26)15-6-4-7-16(12-15)23-21-24-19-10-3-2-9-18(19)20(25-21)22-13-17-8-5-11-27-17/h2-12,14,26H,13H2,1H3,(H2,22,23,24,25)
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| InChIKey |
VUBFROKUEHITHK-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