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

1017201 - Overview - Compound Synopsis

Synonyms
0L5
Molecular Formula
C24H40N3O16P3
InChI
InChI=1S/C24H40N3O16P3/c28-14-10-5-3-1-2-4-8-12-21(30)25-13-9-6-7-11-18-16-27(24(32)26-23(18)31)22-15-19(29)20(41-22)17-40-45(36,37)43-46(38,39)42-44(33,34)35/h16,19-20,22,28-29H,1-6,8-10,12-15,17H2,(H,25,30)(H,36,37)(H,38,39)(H,26,31,32)(H2,33,34,35)/t19-,20+,22+/m0/s1
Smiles
O=C(CCCCCCCCCO)NCCCC#Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O
Cross References
UniChem27265258
canSAR1017201
PDBe (Protein Data Bank Europe)0L5
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 719.162142090.889381986Yes


Compounds with the same scaffold


Image of compound ID: 1017201
Murko Scaffold Family: 1138 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12