General Information of the Compound
| Compound ID |
CP0513878
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| Compound Name |
2-(4-chlorophenoxy)-N-[2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-4-methylquinazolin-6-yl]acetamide
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| Structure |
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| Formula |
C25H26ClN5O3
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| Molecular Weight |
479.968
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| Canonical SMILES |
Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCN(CC1)C(=O)C1CC1
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| InChI |
InChI=1S/C25H26ClN5O3/c1-16-21-14-19(28-23(32)15-34-20-7-4-18(26)5-8-20)6-9-22(21)29-25(27-16)31-12-10-30(11-13-31)24(33)17-2-3-17/h4-9,14,17H,2-3,10-13,15H2,1H3,(H,28,32)
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| InChIKey |
QHXFJXDNPWAFLV-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