General Information of the Compound
| Compound ID |
CP0315925
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| Compound Name |
methyl N-[4-(4-morpholin-4-yl-1-phenylpyrazolo[3,4-d]pyrimidin-6-yl)phenyl]carbamate
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| Structure |
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| Formula |
C23H22N6O3
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| Molecular Weight |
430.468
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| Canonical SMILES |
COC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
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| InChI |
InChI=1S/C23H22N6O3/c1-31-23(30)25-17-9-7-16(8-10-17)20-26-21(28-11-13-32-14-12-28)19-15-24-29(22(19)27-20)18-5-3-2-4-6-18/h2-10,15H,11-14H2,1H3,(H,25,30)
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| InChIKey |
LBUAXQMQACBZHH-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