General Information of the Compound
| Compound ID |
CP0154294
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| Compound Name |
ethyl N-[2-chloro-4-[[7-[2-(diethylamino)ethoxy]-6-methoxyquinazolin-4-yl]amino]phenyl]carbamate
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| Structure |
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| Formula |
C24H30ClN5O4
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| Molecular Weight |
487.988
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| Canonical SMILES |
CCOC(=O)Nc1ccc(Nc2ncnc3cc(OCCN(CC)CC)c(OC)cc23)cc1Cl
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| InChI |
InChI=1S/C24H30ClN5O4/c1-5-30(6-2)10-11-34-22-14-20-17(13-21(22)32-4)23(27-15-26-20)28-16-8-9-19(18(25)12-16)29-24(31)33-7-3/h8-9,12-15H,5-7,10-11H2,1-4H3,(H,29,31)(H,26,27,28)
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| InChIKey |
ZQAYFEZARGPXNS-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