tiotidine

Ligand id: 1235

Name: tiotidine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 4
Rotatable bonds 8
Topological polar surface area 191.04
Molecular weight 312.09
XLogP 0.64
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-cyano-1-[2-[[2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methylsulfanyl]ethyl]-2-methylguanidine
International Nonproprietary Names
INN number INN
4895 tiotidine
Synonyms
ICI 125,211 | ICI-125211
Database Links
BindingDB Ligand 22568
CAS Registry No. 69014-14-8 (source: Scifinder)
ChEMBL Ligand CHEMBL269646
PubChem CID 50287
Search Google for chemical match using the InChIKey YDDXVAXDYKBWDX-UHFFFAOYSA-N
Search Google for chemicals with the same backbone YDDXVAXDYKBWDX
Search PubMed clinical trials tiotidine
Search PubMed titles tiotidine
Search PubMed titles/abstracts tiotidine
Search UniChem for chemical match using the InChIKey YDDXVAXDYKBWDX-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone YDDXVAXDYKBWDX