General Information of the Compound
| Compound ID |
CP0364245
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| Compound Name |
N-(3-bromophenyl)-6,7-dipropoxyquinazolin-4-amine
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| Structure |
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| Formula |
C20H22BrN3O2
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| Molecular Weight |
416.319
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| Canonical SMILES |
CCCOc1cc2ncnc(Nc3cccc(Br)c3)c2cc1OCCC
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| InChI |
InChI=1S/C20H22BrN3O2/c1-3-8-25-18-11-16-17(12-19(18)26-9-4-2)22-13-23-20(16)24-15-7-5-6-14(21)10-15/h5-7,10-13H,3-4,8-9H2,1-2H3,(H,22,23,24)
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| InChIKey |
ZBOJKFDQWQBBHE-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