tiotidine


SMILES N#CNC(=NC)NCCSCc1csc(n1)N=C(N)N
InChIKey YDDXVAXDYKBWDX-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 4
Rotatable bonds 6
Molecular weight (Da) 312.1

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Ligand site mutations H2

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H2 HRH2 Human Histamine A pKi 7.75 7.75 7.75 ChEMBL
H1 HRH1 Human Histamine A pKi 5.0 5.0 5.0 PDSP Ki database
H2 HRH2 Human Histamine A pKi 5.0 6.4 7.8 PDSP Ki database
H2 HRH2 Human Histamine A pKd 7.7 8.2 8.7 Guide to Pharmacology
H2 HRH2 Rat Histamine A pKi 7.5 7.5 7.5 Guide to Pharmacology
H3 HRH3 Rat Histamine A pKi 5.0 5.0 5.0 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H2 HRH2 Human Histamine A pIC50 7.66 7.66 7.66 ChEMBL