General Information of the Compound
| Compound ID |
CP0395895
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| Compound Name |
4-(Benzylamino)quinazoline deriv. 9
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| Structure |
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| Formula |
C16H15N3O
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| Molecular Weight |
265.316
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| Canonical SMILES |
COc1ccc(CNc2ncnc3ccccc23)cc1
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| InChI |
InChI=1S/C16H15N3O/c1-20-13-8-6-12(7-9-13)10-17-16-14-4-2-3-5-15(14)18-11-19-16/h2-9,11H,10H2,1H3,(H,17,18,19)
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| InChIKey |
MCZPCSYKZMFAHI-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
Protein ID: PT00922, Epidermal growth factor receptor
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic