General Information of the Compound
| Compound ID |
CP0092896
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| Compound Name |
butyl N-[4-[(6,7-dimethoxyquinazolin-4-yl)amino]-2-methylphenyl]carbamate
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| Structure |
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| Formula |
C22H26N4O4
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| Molecular Weight |
410.474
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| Canonical SMILES |
CCCCOC(=O)Nc1ccc(Nc2ncnc3cc(OC)c(OC)cc23)cc1C
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| InChI |
InChI=1S/C22H26N4O4/c1-5-6-9-30-22(27)26-17-8-7-15(10-14(17)2)25-21-16-11-19(28-3)20(29-4)12-18(16)23-13-24-21/h7-8,10-13H,5-6,9H2,1-4H3,(H,26,27)(H,23,24,25)
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| InChIKey |
IQOOKGNLIGNDSW-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