Common name
N,N-dimethylmethanamine
IUPAC name
N,N-dimethylmethanamine
SMILES
N(C)(C)C
Common name
N,N-dimethylmethanamine
IUPAC name
N,N-dimethylmethanamine
SMILES
N(C)(C)C
INCHI
InChI=1S/C3H9N/c1-4(2)3/h1-3H3
FORMULA
C3H9N
Common name
N,N-dimethylmethanamine
IUPAC name
N,N-dimethylmethanamine
Molecular weight
59.110
clogP
-0.577
clogS
-0.200
Frequency
0.0371
HBond Acceptor
1
HBond Donor
0
Total PolarSurface Area
3.24
Number of Rings
0
Rotatable Bond
0
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD01083 | Chlorprothixene |
|
Antipsychotic Agents; Dopamine Antagonists; Nervous System; Psycholeptics; Thioxanthene Derivatives; | For treatment of psychotic disorders (e.g. schizophrenia) and of acute mania occuring as part of bipolar disorders. |
| FDBD01086 | Clomipramine |
|
May be used to treat obsessive-compulsive disorder and disorders with an obsessive-compulsive component (e.g. depression, schizophrenia, Tourette's disorder). | |
| FDBD01089 | Decamethonium |
|
Neuromuscular Depolarizing Agents; | For use as a skeletal muscle relaxant. |
| FDBD01090 | Alimemazine |
|
Antipruritics; Respiratory System; Antihistamines for Systemic Use; Phenothiazine Derivatives; CYP3A4 Inhibitors; | Used to prevent and relieve allergic conditions which cause pruritus (itching) and urticaria (some allergic skin reactions). |
| FDBD01126 | Oxtriphylline |
|
Bronchodilator Agents; Respiratory System; Drugs for Obstructive Airway Diseases; Xanthines; Xanthines and Adrenergics; Cytochrome P-450 CYP1A2 Inhibitors; Cytochrome P-450 CYP1A2 Inducers; | Used to treat the symptoms of asthma, bronchitis, COPD, and emphysema. |
| FDBD01179 | Neostigmine |
|
Cholinesterase Inhibitors; Parasympathomimetics; Ophthalmologicals; Sensory Organs; Nervous System; Antiglaucoma Preparations and Miotics; Anticholinesterases; | Neostigmine is used for the symptomatic treatment of myasthenia gravis by improving muscle tone. |
| FDBD01180 | Trisalicylate-choline |
|
; | Choline magnesium trisalicylate is used to reduce pain and inflammation caused by conditions such as arthritis. This medication is also used to treat fever in adults. |
| FDBD01181 | Methotrimeprazine |
|
Antipsychotic Agents; Analgesics, Non-Narcotic; Adrenergic alpha-1 Receptor Antagonists; Dopamine Antagonists; Nervous System; Psycholeptics; Phenothiazines With Aliphatic Side-Chain; Cytochrome P-450 CYP1A2 Inhibitors; Cytochrome P-450 CYP1A2 Inducers; CYP2D6 Inducers; CYP2D6 Inducers (strong); CYP2E1 Inhibitors; CYP2E1 Inducers; CYP2E1 Inducers (strong); | For the treatment of psychosis, particular those of schizophrenia, and manic phases of bipolar disorder. |
| FDBD01264 | Acepromazine |
|
Hypnotics and Sedatives; Antipsychotic Agents; Adrenergic alpha-1 Receptor Antagonists; Dopamine Antagonists; Nervous System; Psycholeptics; Phenothiazines With Aliphatic Side-Chain; | Acepromazine was first used in humans in the 1950s as an antipsychotic agent. It is now rarely used in humans. Acepromazine is frequently used in animals as a sedative and antiemetic. Its principal value is in quietening and calming anxious animals. |
| FDBD01269 | Pheniramine |
|
Anti-Allergic Agents; Antipruritics; Histamine H1 Antagonists; Respiratory System; Dermatologicals; Antipruritics, Incl. Antihistamines, Anesthetics, Etc.; Antihistamines for Topical Use; Antihistamines for Systemic Use; Substituted Alkylamines; | Pheniramine is an antihistamine used to treat allergic conditions such as hay fever or urticaria. |
108 ,
11
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 2reg_ligand_1_1.mol2 | 2reg | 1 | -5.84 | C[N+](C)(C)C | 5 |
| 2rin_ligand_1_0.mol2 | 2rin | 1 | -5.74 | C[N+](C)(C)C | 5 |
| 4bgk_ligand_1_3.mol2 | 4bgk | 1 | -5.64 | [N+](C)(C)(C)C | 5 |
| 4c5w_ligand_1_0.mol2 | 4c5w | 1 | -5.64 | C[N+](C)(C)C | 5 |
| 1sw2_ligand_frag_0.mol2 | 1sw2 | 1 | -5.63 | [NH+](C)(C)C | 4 |
892 ,
90
