General Information of the Compound
| Compound ID |
CP0487218
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| Compound Name |
1-Ethyl-3-(1-(2- (piperidin-1-yl)ethyl)-1H- pyrazolo[3,4- d]pyrimidin-4-yl)urea hydrochloride
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| Structure |
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| Formula |
C15H23N7O
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| Molecular Weight |
317.397
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| Canonical SMILES |
CCNC(=O)Nc1ncnc2n(CCN3CCCCC3)ncc12
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| InChI |
InChI=1S/C15H23N7O/c1-2-16-15(23)20-13-12-10-19-22(14(12)18-11-17-13)9-8-21-6-4-3-5-7-21/h10-11H,2-9H2,1H3,(H2,16,17,18,20,23)
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| InChIKey |
DUVUROKKHZRURZ-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