General Information of the Compound
| Compound ID |
CP0862839
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| Compound Name |
(S)-N-cyclopropyl-3-(4-((2,5-difluorophenyl)fluoromethyl)piperidin-1-yl)-7-methylpyrido[3,4-b]pyrazin-2-amine
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| Structure |
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| Formula |
C23H24F3N5
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| Molecular Weight |
427.474
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| Canonical SMILES |
Cc1cc2nc(NC3CC3)c(N3CCC([C@H](F)c4cc(F)ccc4F)CC3)nc2cn1
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| InChI |
InChI=1S/C23H24F3N5/c1-13-10-19-20(12-27-13)30-23(22(29-19)28-16-3-4-16)31-8-6-14(7-9-31)21(26)17-11-15(24)2-5-18(17)25/h2,5,10-12,14,16,21H,3-4,6-9H2,1H3,(H,28,29)/t21-/m0/s1
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| InChIKey |
NZABAQPLUXTEIV-NRFANRHFSA-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