General Information of the Compound
| Compound ID |
CP0396844
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| Compound Name |
(1S,2S,3R,5S)-3-(4-amino-7-fluoroimidazo[4,5-c]pyridin-1-yl)-5-fluorocyclopentane-1,2-diol
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| Structure |
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| Formula |
C11H12F2N4O2
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| Molecular Weight |
270.239
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| Canonical SMILES |
Nc1ncc(F)c2n(cnc12)[C@@H]1C[C@H](F)[C@@H](O)[C@H]1O
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| InChI |
InChI=1S/C11H12F2N4O2/c12-4-1-6(10(19)9(4)18)17-3-16-7-8(17)5(13)2-15-11(7)14/h2-4,6,9-10,18-19H,1H2,(H2,14,15)/t4-,6+,9+,10-/m0/s1
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| InChIKey |
LCLSBQXXBKEFFS-ZUUNNNKKSA-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