General Information of the Compound
| Compound ID |
CP0875477
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| Compound Name |
N-(4-{1-[(2-Methoxyethyl)amino]ethyl}phenyl)-6-pyridin-4-ylquinazolin-2-amine
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| Structure |
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| Formula |
C24H25N5O
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| Molecular Weight |
399.498
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| Canonical SMILES |
COCCNC(C)c1ccc(Nc2ncc3cc(-c4ccncc4)ccc3n2)cc1
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| InChI |
InChI=1S/C24H25N5O/c1-17(26-13-14-30-2)18-3-6-22(7-4-18)28-24-27-16-21-15-20(5-8-23(21)29-24)19-9-11-25-12-10-19/h3-12,15-17,26H,13-14H2,1-2H3,(H,27,28,29)
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| InChIKey |
GTVDKMPFFQQVEL-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