daltroban


SMILES OC(=O)Cc1ccc(cc1)CCNS(=O)(=O)c1ccc(cc1)Cl
InChIKey IULOBWFWYDMECP-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 353.0

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Structure pdb 6IIV

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H3 HRH3 Human Histamine A pKi 8.3 8.3 8.3 Guide to Pharmacology
H3 HRH3 Rat Histamine A pKi 8.3 8.3 8.3 Guide to Pharmacology
H3 HRH3 Guinea pig Histamine A pKd 8.4 8.4 8.4 ChEMBL
H4 HRH4 Human Histamine A pKi 6.2 6.47 6.6 ChEMBL
H3 HRH3 Human Histamine A pKi 7.43 8.08 8.3 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H3 HRH3 Human Histamine A pEC50 8.3 8.44 8.63 ChEMBL