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

1103749 - Overview - Compound Synopsis

Synonyms
DJF
Molecular Formula
C20H24BN5O10P-
InChI
InChI=1S/C20H22BN5O9P/c22-18-15-19(24-9-23-18)26(10-25-15)20-17-16(13(33-20)8-32-36(28)29)34-21(35-17)14-11(7-31-21)3-1-4-12(14)30-6-2-5-27/h1,3-4,9-10,13,16-17,20,27H,2,5-8H2,(H2,22,23,24)/q-1/t13-,16-,17-,20-,21+/m1/s1
Smiles
Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C2O[B-]3(OCc4cccc(OCCCO)c43)OC21
Cross References
UniChem31961772
canSAR1103749
PDBe (Protein Data Bank Europe)DJF
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 536.13593257791-0.663351561No