General Information of the Compound
| Compound ID |
CP0564747
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| Compound Name |
2-[1-ethyl-3-[4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-4-yl]pyrazol-1-yl]azetidin-3-yl]acetonitrile
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| Structure |
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| Formula |
C20H21N9
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| Molecular Weight |
387.451
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| Canonical SMILES |
CCN1CC(CC#N)(C1)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C)c1
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| InChI |
InChI=1S/C20H21N9/c1-3-27-13-20(14-27,5-6-21)29-11-16(9-24-29)19-18-4-7-22-28(18)12-17(25-19)15-8-23-26(2)10-15/h4,7-12H,3,5,13-14H2,1-2H3
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| InChIKey |
LSEHWUWQKGKULM-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