N-α-methylhistamine


SMILES CNCCc1cnc[nH]1
InChIKey PHSPJQZRQAJPPF-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 125.1

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Ligand site mutations H3

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Human Opioid A pKi 6.5 6.5 6.5 Guide to Pharmacology
μ OPRM Human Opioid A pKi 9.3 9.3 9.3 Guide to Pharmacology
μ OPRM Rat Opioid A pKi 8.7 8.7 8.7 Guide to Pharmacology
κ OPRK Rat Opioid A pKi 5.9 5.9 5.9 Guide to Pharmacology
CCK2 GASR Human Cholecystokinin A pKi 7.96 7.96 7.96 ChEMBL
μ OPRM Rat Opioid A pKi 7.8 8.73 9.28 ChEMBL
μ OPRM Human Opioid A pKi 5.66 8.73 9.55 ChEMBL
δ OPRD Human Opioid A pKi 5.82 6.47 9.18 ChEMBL
δ OPRD Human Opioid A pKd 5.73 5.73 5.73 ChEMBL
κ OPRK Human Opioid A pKi 6.51 6.53 6.57 ChEMBL
κ OPRK Guinea pig Opioid A pKi 5.24 5.49 5.74 ChEMBL
κ OPRK Guinea pig Opioid A pKd 6.29 6.29 6.29 ChEMBL
NOP OPRX Guinea pig Opioid A pKi 7.57 7.57 7.57 ChEMBL
μ OPRM Mouse Opioid A pKi 9.08 9.21 9.34 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCK2 GASR Human Cholecystokinin A pEC50 8.57 8.57 8.57 ChEMBL
μ OPRM Rat Opioid A pIC50 7.44 8.3 9.0 ChEMBL
μ OPRM Rat Opioid A pEC50 6.84 7.52 9.59 ChEMBL
μ OPRM Human Opioid A pIC50 7.7 8.7 9.37 ChEMBL
μ OPRM Human Opioid A pEC50 6.42 7.6 9.52 ChEMBL
δ OPRD Human Opioid A pIC50 8.84 8.84 8.84 ChEMBL
δ OPRD Human Opioid A pEC50 6.4 7.28 8.16 ChEMBL
κ OPRK Human Opioid A pEC50 5.36 5.38 5.4 ChEMBL
δ OPRD Mouse Opioid A pIC50 5.81 5.91 6.02 ChEMBL
κ OPRK Mouse Opioid A pEC50 5.4 5.4 5.4 ChEMBL
μ OPRM Mouse Opioid A pIC50 7.12 8.09 8.86 ChEMBL
μ OPRM Mouse Opioid A pEC50 7.72 7.94 8.3 ChEMBL