Ligand Id: 2379
Ligand name taurine

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 88.77
Molecular weight 125.01
XLogP -1.68
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands
Classification
Compound class Metabolite or derivative
DrugBank groups experimental
IUPAC Name
2-aminoethanesulfonic acid
International Nonproprietary Names
INN number INN
6171 taurine
Database Links
CAS Registry No. 107-35-7 (source: DrugBank)
ChEBI CHEBI:507393, CHEBI:15891
ChEMBL Ligand 507393
DrugBank Ligand DB01956
Human Metabolome Database HMDB00251
PharmGKB Drug PA451590
PubChem CID 1123
RCSB PDB Ligand TAU
Search on ChemSpider XOAAWQZATWQOTB-UHFFFAOYSA-N
Wikipedia Taurine
ZINC ZINC03809490

Please note: some links may refer to related isomers. For more details please contact: curators@iuphar-db.org

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