General Information of the Compound
| Compound ID |
CP0399191
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| Compound Name |
N-methyl-4-[2-(4-pyridin-3-ylanilino)quinazolin-6-yl]oxypyridine-2-carboxamide
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| Structure |
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| Formula |
C26H20N6O2
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| Molecular Weight |
448.486
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| Canonical SMILES |
CNC(=O)c1cc(Oc2ccc3nc(Nc4ccc(cc4)-c4cccnc4)ncc3c2)ccn1
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| InChI |
InChI=1S/C26H20N6O2/c1-27-25(33)24-14-22(10-12-29-24)34-21-8-9-23-19(13-21)16-30-26(32-23)31-20-6-4-17(5-7-20)18-3-2-11-28-15-18/h2-16H,1H3,(H,27,33)(H,30,31,32)
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| InChIKey |
GKKSHWWDZSJINW-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