General Information of the Compound
| Compound ID |
CP0383329
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2'-acetylamino-2'-deoxy-2-thiouridine 5'-triphosphate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C11H18N3O14P3S
|
||||||||||||||||||
| Molecular Weight |
541.261
|
||||||||||||||||||
| Canonical SMILES |
CC(=O)N[C@@H]1[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1ccc(=O)[nH]c1=S
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C11H18N3O14P3S/c1-5(15)12-8-9(17)6(26-10(8)14-3-2-7(16)13-11(14)32)4-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-3,6,8-10,17H,4H2,1H3,(H,12,15)(H,21,22)(H,23,24)(H,13,16,32)(H2,18,19,20)/t6-,8-,9-,10-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
NKLAEOKLJQXFBS-PEBGCTIMSA-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 | |||||||||||||||||||
| ChEMBL 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