Common name
2-methoxy-N-methyl-benzamide
IUPAC name
2-methoxy-N-methyl-benzamide
SMILES
CNC(=O)c1ccccc1OC
Common name
2-methoxy-N-methyl-benzamide
IUPAC name
2-methoxy-N-methyl-benzamide
SMILES
CNC(=O)c1ccccc1OC
INCHI
InChI=1S/C9H11NO2/c1-10-9(11)7-5-3-4-6-8(7)12-2/h3-6H,1-2H3,(H,10,11)
FORMULA
C9H11NO2
Common name
2-methoxy-N-methyl-benzamide
IUPAC name
2-methoxy-N-methyl-benzamide
Molecular weight
165.189
clogP
1.377
clogS
-2.299
Frequency
0.0007
HBond Acceptor
2
HBond Donor
1
Total PolarSurface Area
38.33
Number of Rings
1
Rotatable Bond
2
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD00271 | Sulpiride |
|
Antidepressive Agents, Second-Generation; Antipsychotic Agents; Dopamine Antagonists; Antidepressive Agents; Nervous System; Psycholeptics; Benzamides; | Sulpiride is indicated for the treatment of schizophrenia. |
| FDBD01041 | Flecainide |
|
Anti-Arrhythmia Agents; Voltage-Gated Sodium Channel Blockers; Cardiovascular System; Antiarrhythmics, Class I and Iii; Cardiac Therapy; Antiarrythmics, Class I and Iii; Antiarrhythmics, Class Ic; Cytochrome P-450 CYP2C9 Inhibitors; Cytochrome P-450 CYP2C9 Inducers; CYP2D6 Inducers; CYP2D6 Inducers (strong); | Flecainide is is a class Ic antiarrhythmic agent and as such, it is used for the prevention of paroxysmal supraventricular tachycardias (PSVT), including atrioventricular nodal reentrant tachycardia, atrioventricular reentrant tachycardia and other supraventricular tachycardias of unspecified mechanism associated with disablin. |
2 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 2v13_ligand_4_1379.mol2 | 2v13 | 1 | -6.64 | COc1ccccc1C(=O)NC | 12 |
| 2v12_ligand_4_1695.mol2 | 2v12 | 1 | -6.59 | COc1ccccc1C(=O)NC | 12 |
| 4ngp_ligand_4_2056.mol2 | 4ngp | 1 | -6.20 | CNC(=O)c1c(cccc1)OC | 12 |
| 2v12_ligand_5_5565.mol2 | 2v12 | 0.924528 | -6.87 | CCNC(=O)c1c(cccc1)OC | 13 |
| 4ngp_ligand_5_7260.mol2 | 4ngp | 0.924528 | -6.47 | CCNC(=O)c1c(cccc1)OC | 13 |
| 2xln_ligand_3_2.mol2 | 2xln | 0.924528 | -6.32 | O(C)c1c(C(=O)NCC)cccc1 | 13 |
| 2xln_ligand_3_1.mol2 | 2xln | 0.924528 | -6.25 | O(C)c1c(C(=O)NCC)cccc1 | 13 |
| 2v13_ligand_5_3185.mol2 | 2v13 | 0.890909 | -6.96 | CCOc1ccccc1C(=O)NC | 13 |
| 2v12_ligand_5_4200.mol2 | 2v12 | 0.890909 | -6.91 | C(C)Oc1ccccc1C(=O)NC | 13 |
| 4ngp_ligand_5_5440.mol2 | 4ngp | 0.890909 | -6.44 | CNC(=O)c1c(cccc1)OCC | 13 |
103 ,
11
