General Information of the Compound
| Compound ID |
CP0474654
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| Compound Name |
2-(4-chlorophenoxy)-N-[2-(4-ethyl-4-hydroxypiperidin-1-yl)-4-methylquinazolin-6-yl]acetamide
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| Structure |
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| Formula |
C24H27ClN4O3
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| Molecular Weight |
454.958
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| Canonical SMILES |
CCC1(O)CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(Cl)cc3)ccc2n1
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| InChI |
InChI=1S/C24H27ClN4O3/c1-3-24(31)10-12-29(13-11-24)23-26-16(2)20-14-18(6-9-21(20)28-23)27-22(30)15-32-19-7-4-17(25)5-8-19/h4-9,14,31H,3,10-13,15H2,1-2H3,(H,27,30)
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| InChIKey |
YYAGULWMROZPSR-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