General Information of the Compound
| Compound ID |
CP0536207
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| Compound Name |
N-(1-(2-(pyrrolidin-1- yl)ethyl)-1H-pyrazolo[3,4- d]pyrimidin-4- yl)cyclohexanecarboxamide maleate
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| Structure |
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| Formula |
C18H26N6O
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| Molecular Weight |
342.447
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| Canonical SMILES |
O=C(Nc1ncnc2n(CCN3CCCC3)ncc12)C1CCCCC1
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| InChI |
InChI=1S/C18H26N6O/c25-18(14-6-2-1-3-7-14)22-16-15-12-21-24(17(15)20-13-19-16)11-10-23-8-4-5-9-23/h12-14H,1-11H2,(H,19,20,22,25)
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| InChIKey |
BVKRUWAKCUNBRP-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