General Information of the Compound
| Compound ID |
CP0408742
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| Compound Name |
2-(4-chlorophenoxy)-N-[2-[4-(2,2-dimethylpropyl)piperazin-1-yl]-4-methylquinazolin-6-yl]acetamide
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| Structure |
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| Formula |
C26H32ClN5O2
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| Molecular Weight |
482.028
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| Canonical SMILES |
Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCN(CC(C)(C)C)CC1
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| InChI |
InChI=1S/C26H32ClN5O2/c1-18-22-15-20(29-24(33)16-34-21-8-5-19(27)6-9-21)7-10-23(22)30-25(28-18)32-13-11-31(12-14-32)17-26(2,3)4/h5-10,15H,11-14,16-17H2,1-4H3,(H,29,33)
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| InChIKey |
AADREHBCWGMZDZ-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