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

704304 - Overview - Compound Synopsis

Synonyms
BRUUBR
Molecular Formula
C9H12BrN2O8P
InChI
InChI=1S/C9H12BrN2O8P/c10-4-2-12(9(15)11-8(4)14)7-1-5(13)6(20-7)3-19-21(16,17)18/h2,5-7,13H,1,3H2,(H,11,14,15)(H2,16,17,18)/t5-,6+,7+/m0/s1
Smiles
O=c1[nH]c(=O)n([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)cc1Br
Cross References
UniChem407381
canSAR704304
PDBe (Protein Data Bank Europe)BRU
ChEMBLCHEMBL1160593
BindingDB50010238
PDBe (Protein Data Bank Europe)UBR
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 385.951464074-0.943241033No