General Information of the Compound
| Compound ID |
CP0965689
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
Cyclo-4-amino-5-iodo-7-beta-D-ribofuranosyl-7H-pyrrolo[2,3-d]-pyrimidine5'-O-phosphate(3'->5')Guanosine5'-O-phosphate(3'->5')
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H24IN9O13P2
|
||||||||||||||||||
| Molecular Weight |
799.325
|
||||||||||||||||||
| Canonical SMILES |
Nc1nc2c(ncn2[C@@H]2O[C@@H]3COP(=O)(O)O[C@H]4[C@@H](O)[C@H](n5cc(I)c6c(N)ncnc65)O[C@@H]4COP(=O)(O)O[C@H]3[C@H]2O)c(=O)[nH]1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H24IN9O13P2/c22-6-1-30(16-9(6)15(23)25-4-26-16)19-11(32)13-7(41-19)2-39-46(37,38)44-14-8(3-40-45(35,36)43-13)42-20(12(14)33)31-5-27-10-17(31)28-21(24)29-18(10)34/h1,4-5,7-8,11-14,19-20,32-33H,2-3H2,(H,35,36)(H,37,38)(H2,23,25,26)(H3,24,28,29,34)/t7-,8-,11-,12-,13-,14-,19-,20-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
YJVVQHCDXSDCCL-XPWFQUROSA-N
|
||||||||||||||||||
| 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
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
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 |
|
|---|
Table of Molecular Bioactivities Related to the Compound