GTPγS

Ligand id: 4207

Name: GTPγS

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 16
Hydrogen bond donors 8
Rotatable bonds 8
Topological polar surface area 343.55
Molecular weight 538.97
XLogP -2.32
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
({[({[5-(2-amino-6-oxo-6,9-dihydro-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)(sulfanylidene)phosphonous acid
Database Links
GtoPdb PubChem SID 178101024
PubChem CID 1764
RCSB PDB Ligand 102
Search Google for chemical match using the InChIKey XOFLBQFBSOEHOG-UHFFFAOYSA-N
Search Google for chemicals with the same backbone XOFLBQFBSOEHOG
Search UniChem for chemical match using the InChIKey XOFLBQFBSOEHOG-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone XOFLBQFBSOEHOG