General Information of the Compound
| Compound ID |
CP0426983
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| Compound Name |
2-(4-chlorophenoxy)-N-(4-methyl-2-piperidin-1-ylquinazolin-6-yl)acetamide
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| Structure |
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| Formula |
C22H23ClN4O2
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| Molecular Weight |
410.905
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| Canonical SMILES |
Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCCCC1
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| InChI |
InChI=1S/C22H23ClN4O2/c1-15-19-13-17(25-21(28)14-29-18-8-5-16(23)6-9-18)7-10-20(19)26-22(24-15)27-11-3-2-4-12-27/h5-10,13H,2-4,11-12,14H2,1H3,(H,25,28)
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| InChIKey |
PTQMJIIDCSMCJT-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