Common name
2-hydroxy-N-methyl-benzamide
IUPAC name
2-hydroxy-N-methyl-benzamide
SMILES
CNC(=O)c1c(cccc1)O
Common name
2-hydroxy-N-methyl-benzamide
IUPAC name
2-hydroxy-N-methyl-benzamide
SMILES
CNC(=O)c1c(cccc1)O
INCHI
InChI=1S/C8H9NO2/c1-9-8(11)6-4-2-3-5-7(6)10/h2-5,10H,1H3,(H,9,11)
FORMULA
C8H9NO2
Common name
2-hydroxy-N-methyl-benzamide
IUPAC name
2-hydroxy-N-methyl-benzamide
Molecular weight
151.163
clogP
0.887
clogS
-1.586
Frequency
0.0010
HBond Acceptor
2
HBond Donor
2
Total PolarSurface Area
49.33
Number of Rings
1
Rotatable Bond
1
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| 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. |
| FDBD01813 | Mersalyl |
|
Enzyme Inhibitors; Diuretics; Cardiovascular System; Low-Ceiling Diuretics, Excl. Thiazides; Mercurial Diuretics; | |
| FDBD02956 | trichlamide |
|
Fungicide | Fungicide |
3 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1r6g_ligand_2_15.mol2 | 1r6g | 1 | -6.82 | c1cc(c(cc1)O)C(=O)NC | 11 |
| 2v13_ligand_3_394.mol2 | 2v13 | 1 | -6.63 | Oc1ccccc1C(=O)NC | 11 |
| 4nrb_ligand_2_0.mol2 | 4nrb | 1 | -6.63 | Oc1c(C(=O)NC)cccc1 | 11 |
| 2v12_ligand_3_452.mol2 | 2v12 | 1 | -6.58 | c1(ccccc1C(=O)NC)O | 11 |
| 4ngp_ligand_3_514.mol2 | 4ngp | 1 | -6.23 | CNC(=O)c1c(cccc1)O | 11 |
| 1yms_ligand_3_6.mol2 | 1yms | 0.97619 | -6.88 | CNC(=O)c1c(ccc2c1cccc2)O | 15 |
| 1ny0_ligand_3_6.mol2 | 1ny0 | 0.97619 | -6.44 | CNC(=O)c1c(ccc2c1cccc2)O | 15 |
| 2v12_ligand_4_2059.mol2 | 2v12 | 0.911111 | -6.86 | CCNC(=O)c1c(cccc1)O | 12 |
| 4ngp_ligand_4_2511.mol2 | 4ngp | 0.911111 | -6.50 | CCNC(=O)c1c(cccc1)O | 12 |
| 4rwl_ligand_2_2.mol2 | 4rwl | 0.860465 | -8.16 | Oc1cc2c(c(C(=O)NC)ccc2)cc1 | 15 |
239 ,
24
