General Information of the Compound
| Compound ID |
CP0517545
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| Compound Name |
N-[2-(4-aminopiperidin-1-yl)-4-methylquinazolin-6-yl]-2-(4-chlorophenoxy)acetamide
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| Structure |
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| Formula |
C22H24ClN5O2
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| Molecular Weight |
425.92
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| Canonical SMILES |
Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCC(N)CC1
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| InChI |
InChI=1S/C22H24ClN5O2/c1-14-19-12-17(26-21(29)13-30-18-5-2-15(23)3-6-18)4-7-20(19)27-22(25-14)28-10-8-16(24)9-11-28/h2-7,12,16H,8-11,13,24H2,1H3,(H,26,29)
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| InChIKey |
SMFQUUUKVWCGTO-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