Compound Synopsis
Compound Overview
Bioactivity Data Summary
Protein Affinity Profile
Cellline Sensitivity Profile

751973 - Overview - Compound Synopsis

Synonyms
XYQ
Molecular Formula
C17H25N5O15P2
InChI
InChI=1S/C17H25N5O15P2/c1-6(23)34-17-13(27)11(25)8(36-17)3-33-39(30,31)37-38(28,29)32-2-7-10(24)12(26)16(35-7)22-5-21-9-14(18)19-4-20-15(9)22/h4-5,7-8,10-13,16-17,24-27H,2-3H2,1H3,(H,28,29)(H,30,31)(H2,18,19,20)/t7-,8-,10-,11-,12-,13-,16-,17+/m1/s1
Smiles
CC(=O)O[C@H]1O[C@H](CO[P@@](=O)(O)O[P@](=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O
Cross References
UniChem652583
canSAR751973
PDBe (Protein Data Bank Europe)XYQ
ChEMBLCHEMBL1236876
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 601.08223836-2.711982064Yes


Compounds with the same scaffold


Image of compound ID: 751973
Murko Scaffold Family: 17858 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12