General Information of the Compound
| Compound ID |
CP0545593
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| Compound Name |
N-(3,4-dichlorophenyl)-6-(methyloxy)-7-({[4- (morpholin-4-ylmethyl)-1,3-thiazol-2- yl]methyl}oxy)quinazolin-4-amine
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| Structure |
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| Formula |
C24H23Cl2N5O3S
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| Molecular Weight |
532.453
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| Canonical SMILES |
COc1cc2c(Nc3ccc(Cl)c(Cl)c3)ncnc2cc1OCc1nc(CN2CCOCC2)cs1
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| InChI |
InChI=1S/C24H23Cl2N5O3S/c1-32-21-9-17-20(27-14-28-24(17)30-15-2-3-18(25)19(26)8-15)10-22(21)34-12-23-29-16(13-35-23)11-31-4-6-33-7-5-31/h2-3,8-10,13-14H,4-7,11-12H2,1H3,(H,27,28,30)
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| InChIKey |
FTIMKXNADWOPKE-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