General Information of the Compound
| Compound ID |
CP0567550
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| Compound Name |
5-[[2,6-difluoro-4-(2-methylindazol-4-yl)phenyl]methyl]-1,6-dihydropyrrolo[3,4-d]imidazol-4-one
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| Structure |
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| Formula |
C20H15F2N5O
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| Molecular Weight |
379.37
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| Canonical SMILES |
Cn1cc2c(cccc2n1)-c1cc(F)c(CN2Cc3nc[nH]c3C2=O)c(F)c1
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| InChI |
InChI=1S/C20H15F2N5O/c1-26-7-13-12(3-2-4-17(13)25-26)11-5-15(21)14(16(22)6-11)8-27-9-18-19(20(27)28)24-10-23-18/h2-7,10H,8-9H2,1H3,(H,23,24)
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| InChIKey |
MTURDRWABRJXPY-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