General Information of the Compound
| Compound ID |
CP0326404
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| Compound Name |
(7R)-2-[(3-chlorophenoxy)methyl]-5-(4-fluorophenyl)-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
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| Structure |
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| Formula |
C20H17ClFN3O2
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| Molecular Weight |
385.826
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| Canonical SMILES |
C[C@@H]1CN(C(=O)c2cc(COc3cccc(Cl)c3)nn12)c1ccc(F)cc1
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| InChI |
InChI=1S/C20H17ClFN3O2/c1-13-11-24(17-7-5-15(22)6-8-17)20(26)19-10-16(23-25(13)19)12-27-18-4-2-3-14(21)9-18/h2-10,13H,11-12H2,1H3/t13-/m1/s1
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| InChIKey |
IJRZBSAVSSXKDK-CYBMUJFWSA-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