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

1103793 - Overview - Compound Synopsis

Synonyms
365
Molecular Formula
C21H27BN6O10P-
InChI
InChI=1S/C21H27BN6O10P/c23-7-13-11-3-1-4-12(33-6-2-5-29)15(11)22(36-13)37-17-14(8-34-39(30,31)32)35-21(18(17)38-22)28-10-27-16-19(24)25-9-26-20(16)28/h1,3-4,9-10,13-14,17-18,21,29H,2,5-8,23H2,(H2,24,25,26)(H2,30,31,32)/q-1/p-2/t13-,14-,17-,18-,21-,22+/m1/s1
Smiles
NCC1O[B-]2(OC3C(COP(=O)(O)O)OC(n4cnc5c(N)ncnc54)C3O2)c2c(OCCCO)cccc21
Cross References
UniChem31961755
canSAR1103793
PDBe (Protein Data Bank Europe)365
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 565.16248167391-1.163571666No