General Information of the Compound
| Compound ID |
CP0254319
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| Compound Name |
N-(4-fluorophenyl)-N-methyl-4-oxo-5-[2-[4-(piperidin-1-ylmethyl)phenyl]ethyl]-6,7-dihydropyrazolo[1,5-a]pyrazine-2-carboxamide
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| Structure |
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| Formula |
C28H32FN5O2
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| Molecular Weight |
489.595
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| Canonical SMILES |
CN(C(=O)c1cc2C(=O)N(CCc3ccc(CN4CCCCC4)cc3)CCn2n1)c1ccc(F)cc1
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| InChI |
InChI=1S/C28H32FN5O2/c1-31(24-11-9-23(29)10-12-24)27(35)25-19-26-28(36)33(17-18-34(26)30-25)16-13-21-5-7-22(8-6-21)20-32-14-3-2-4-15-32/h5-12,19H,2-4,13-18,20H2,1H3
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| InChIKey |
CGLCAAPOXYFZGX-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