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

1148390 - Overview - Compound Synopsis

Synonyms
TD9
Molecular Formula
C17H27N4O10P2S+
InChI
InChI=1S/C17H26N4O10P2S/c1-10-14(6-7-30-33(28,29)31-32(25,26)27)34-17(13(22)4-3-5-15(23)24)21(10)9-12-8-19-11(2)20-16(12)18/h8,13,22H,3-7,9H2,1-2H3,(H5-,18,19,20,23,24,25,26,27,28,29)/p-3/t13-/m0/s1
Smiles
Cc1ncc(C[n+]2c(C(O)CCCC(=O)O)sc(CCOP(=O)(O)OP(=O)(O)O)c2C)c(N)n1
Cross References
UniChem68940476
canSAR1148390
PDBe (Protein Data Bank Europe)TD9
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 541.091763744091.1300471461Yes


Compounds with the same scaffold


Image of compound ID: 1148390
Murko Scaffold Family: 45 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12