General Information of the Compound
| Compound ID |
CP0540311
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| Compound Name |
N-[7-methoxy-4-(4-pyridin-3-yloxyanilino)quinazolin-6-yl]propanamide
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| Structure |
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| Formula |
C23H21N5O3
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| Molecular Weight |
415.453
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| Canonical SMILES |
CCC(=O)Nc1cc2c(Nc3ccc(Oc4cccnc4)cc3)ncnc2cc1OC
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| InChI |
InChI=1S/C23H21N5O3/c1-3-22(29)28-20-11-18-19(12-21(20)30-2)25-14-26-23(18)27-15-6-8-16(9-7-15)31-17-5-4-10-24-13-17/h4-14H,3H2,1-2H3,(H,28,29)(H,25,26,27)
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| InChIKey |
VIVGTLWPQZQFPV-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: PT01159, Receptor tyrosine-protein kinase erbB-4