General Information of the Compound
| Compound ID |
CP0516900
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| Compound Name |
4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)quinazoline
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| Structure |
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| Formula |
C18H17N3O
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| Molecular Weight |
291.354
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| Canonical SMILES |
COc1ccc2N(CCCc2c1)c1ncnc2ccccc12
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| InChI |
InChI=1S/C18H17N3O/c1-22-14-8-9-17-13(11-14)5-4-10-21(17)18-15-6-2-3-7-16(15)19-12-20-18/h2-3,6-9,11-12H,4-5,10H2,1H3
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| InChIKey |
MHEDOFSFNFEZFX-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: PT00844, Platelet-derived growth factor receptor beta
Protein ID: PT00864, Vascular endothelial growth factor receptor 2
Cell Viability or Cytotoxicity Assay
| Cell Line ID | Cell Line Name | Cell Line Organism | |
| CL000052 | A-431 | Homo sapiens (Human) | 1 |
| 1 |
IC50 = 16.3 nM
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