General Information of the Compound
| Compound ID |
CP0553571
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| Compound Name |
1-[5-[(6,7-dimethoxyquinazolin-4-yl)amino]-2,3-dihydroindol-1-yl]-2-indol-1-ylethanone
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| Structure |
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| Formula |
C28H25N5O3
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| Molecular Weight |
479.54
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| Canonical SMILES |
COc1cc2ncnc(Nc3ccc4N(CCc4c3)C(=O)Cn3ccc4ccccc34)c2cc1OC
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| InChI |
InChI=1S/C28H25N5O3/c1-35-25-14-21-22(15-26(25)36-2)29-17-30-28(21)31-20-7-8-24-19(13-20)10-12-33(24)27(34)16-32-11-9-18-5-3-4-6-23(18)32/h3-9,11,13-15,17H,10,12,16H2,1-2H3,(H,29,30,31)
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| InChIKey |
RJMAYRZVDYOGIG-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