General Information of the Compound
| Compound ID |
CP0430579
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| Compound Name |
4-(6,7-Dimethoxy-2-phenylamino-quinazolin-4-yloxy)-butyric acid ethyl ester
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| Structure |
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| Formula |
C22H25N3O5
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| Molecular Weight |
411.458
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| Canonical SMILES |
CCOC(=O)CCCOc1nc(Nc2ccccc2)nc2cc(OC)c(OC)cc12
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| InChI |
InChI=1S/C22H25N3O5/c1-4-29-20(26)11-8-12-30-21-16-13-18(27-2)19(28-3)14-17(16)24-22(25-21)23-15-9-6-5-7-10-15/h5-7,9-10,13-14H,4,8,11-12H2,1-3H3,(H,23,24,25)
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| InChIKey |
NZXZEYGXXZAAEE-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