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

1017363 - Overview - Compound Synopsis

Synonyms
0KL
Molecular Formula
C14H22N3O14P3
InChI
InChI=1S/C14H22N3O14P3/c15-5-3-1-2-4-9-7-17(14(20)16-13(9)19)12-6-10(18)11(29-12)8-28-33(24,25)31-34(26,27)30-32(21,22)23/h7,10-12,18H,1,3,5-6,8,15H2,(H,24,25)(H,26,27)(H,16,19,20)(H2,21,22,23)/t10-,11+,12+/m0/s1
Smiles
NCCCC#Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O
Cross References
UniChem27265130
canSAR1017363
PDBe (Protein Data Bank Europe)0KL
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 549.031462274-1.381381756Yes


Compounds with the same scaffold


Image of compound ID: 1017363
Murko Scaffold Family: 1138 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12