General Information of the Compound
| Compound ID |
CP0308405
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| Compound Name |
3-(4-morpholino-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)aniline
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| Structure |
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| Formula |
C21H20N6O
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| Molecular Weight |
372.432
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| Canonical SMILES |
Nc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
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| InChI |
InChI=1S/C21H20N6O/c22-16-6-4-5-15(13-16)19-24-20(26-9-11-28-12-10-26)18-14-23-27(21(18)25-19)17-7-2-1-3-8-17/h1-8,13-14H,9-12,22H2
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| InChIKey |
DWESOYJSBBZUMD-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