General
Preferred name
Trigonellamide
Synonyms
1-Methylnicotinamide (chloride) ()
1-methylpyridin-1-ium-3-carboxamide hydrochloride ()
3-Carbamoyl-1-methylpyridinium Chloride ()
Nicotinamide Chloromethylate ()
1-Methylnicotinamide chloride ()
N1-methylnicotinamide ()
TRIA-662 ()
1-MNA, 3-Carbamoyl-1-methylpyridin-1-ium chloride, Trigonellamide chloride ()
N1-methylnicotinamide ()
Trigonellinamide ()
1-mna ()
1-Methylnicotinamide (chloride?) ()
P&D ID
PD050335
CAS
1005-24-9
3106-60-3
Tags
available
drug candidate
Drug indication
Hyperlipidemia
Drug Status
investigational
Max Phase
2.0
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
13
Cayman Chemical Bioactives
ChEMBL Drugs
Concise Guide to Pharmacology 2017/18
Concise Guide to Pharmacology 2019/20
Concise Guide to Pharmacology 2021/22
Concise Guide to Pharmacology 2023/24
DrugBank
DrugMAP
Guide to Pharmacology
MedChem Express Bioactive Compound Library
ReFrame library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
54
Properties
(calculated by RDKit )
Molecular Weight
137.07
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
1
Rotatable Bonds
1
Ring Count
1
Aromatic Ring Count
1
cLogP
-0.39
TPSA
46.97
Fraction CSP3
0.14
Chiral centers
0.0
Largest ring
6.0
QED
0.53
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Metabolic Enzyme/Protease
Target
Endogenous Metabolite
Prostaglandin Receptor
Source data
