General Information of the Compound
| Compound ID |
CP0362786
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| Compound Name |
5-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-3-fluoroanilino]-3-(4-fluorophenyl)-1,6-naphthyridin-4-ol
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| Structure |
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| Formula |
C30H21F2N5O4
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| Molecular Weight |
553.525
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| Canonical SMILES |
COc1cc2ncnc(Oc3ccc(Nc4nccc5[nH]cc(-c6ccc(F)cc6)c(=O)c45)cc3F)c2cc1OC
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| InChI |
InChI=1S/C30H21F2N5O4/c1-39-25-12-19-23(13-26(25)40-2)35-15-36-30(19)41-24-8-7-18(11-21(24)32)37-29-27-22(9-10-33-29)34-14-20(28(27)38)16-3-5-17(31)6-4-16/h3-15H,1-2H3,(H,33,37)(H,34,38)
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| InChIKey |
QOMGQLZYIUPQLG-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