General Information of the Compound
| Compound ID |
CP0952826
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| Compound Name |
Cyclo-4-amino-5-(furan-2-yl)-7-beta-D-ribofuranosyl-7H-pyrrolo-[2,3-d]pyrimidine5'-O-phosphate(3'->5')Guanosine5'-Ophosphate(2'->5')
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| Structure |
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| Formula |
C25H27N9O14P2
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| Molecular Weight |
739.488
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| Canonical SMILES |
Nc1nc2c(ncn2[C@@H]2O[C@@H]3COP(=O)(O)O[C@H]4[C@@H](O)[C@H](n5cc(-c6ccco6)c6c(N)ncnc65)O[C@@H]4COP(=O)(O)O[C@@H]2[C@@H]3O)c(=O)[nH]1
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| InChI |
InChI=1S/C25H27N9O14P2/c26-19-13-9(10-2-1-3-42-10)4-33(20(13)29-7-28-19)23-16(36)17-12(46-23)6-44-50(40,41)48-18-15(35)11(5-43-49(38,39)47-17)45-24(18)34-8-30-14-21(34)31-25(27)32-22(14)37/h1-4,7-8,11-12,15-18,23-24,35-36H,5-6H2,(H,38,39)(H,40,41)(H2,26,28,29)(H3,27,31,32,37)/t11-,12-,15-,16-,17-,18-,23-,24-/m1/s1
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| InChIKey |
ZVEYHVPOSVKJOI-INLCHHDGSA-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