General Information of the Compound
| Compound ID |
CP0490972
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| Compound Name |
1-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)-3,6-dimethyl-N-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
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| Structure |
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| Formula |
C21H29N5O3
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| Molecular Weight |
399.495
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| Canonical SMILES |
CCCN(CCOC)c1nc(C)nc2n(nc(C)c12)-c1ccc(OC)cc1OC
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| InChI |
InChI=1S/C21H29N5O3/c1-7-10-25(11-12-27-4)20-19-14(2)24-26(21(19)23-15(3)22-20)17-9-8-16(28-5)13-18(17)29-6/h8-9,13H,7,10-12H2,1-6H3
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| InChIKey |
HYOOIXPPYXUKSR-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