General Information of the Compound
| Compound ID |
CP0146997
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| Compound Name |
1-[4-(1H-pyrazolo[3,4-d]pyrimidin-4-yloxy)phenyl]-3-pyridin-3-ylurea
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| Structure |
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| Formula |
C17H13N7O2
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| Molecular Weight |
347.338
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| Canonical SMILES |
O=C(Nc1ccc(Oc2ncnc3n[nH]cc23)cc1)Nc1cccnc1
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| InChI |
InChI=1S/C17H13N7O2/c25-17(23-12-2-1-7-18-8-12)22-11-3-5-13(6-4-11)26-16-14-9-21-24-15(14)19-10-20-16/h1-10H,(H2,22,23,25)(H,19,20,21,24)
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| InChIKey |
KFUQJGBOFJJPNY-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