Common name
2-hydroxy-N-(methoxymethyl)benzamide
IUPAC name
2-hydroxy-N-(methoxymethyl)benzamide
SMILES
COCNC(=O)c1c(cccc1)O
Common name
2-hydroxy-N-(methoxymethyl)benzamide
IUPAC name
2-hydroxy-N-(methoxymethyl)benzamide
SMILES
COCNC(=O)c1c(cccc1)O
INCHI
InChI=1S/C9H11NO3/c1-13-6-10-9(12)7-4-2-3-5-8(7)11/h2-5,11H,6H2,1H3,(H,10,12)
FORMULA
C9H11NO3
Common name
2-hydroxy-N-(methoxymethyl)benzamide
IUPAC name
2-hydroxy-N-(methoxymethyl)benzamide
Molecular weight
181.189
clogP
0.779
clogS
-1.749
Frequency
0.0003
HBond Acceptor
3
HBond Donor
2
Total PolarSurface Area
58.56
Number of Rings
1
Rotatable Bond
3
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD02956 | trichlamide |
|
Fungicide | Fungicide |
1 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1r6g_ligand_2_15.mol2 | 1r6g | 0.803922 | -6.82 | c1cc(c(cc1)O)C(=O)NC | 11 |
| 2v13_ligand_3_394.mol2 | 2v13 | 0.803922 | -6.63 | Oc1ccccc1C(=O)NC | 11 |
| 4nrb_ligand_2_0.mol2 | 4nrb | 0.803922 | -6.63 | Oc1c(C(=O)NC)cccc1 | 11 |
| 2v12_ligand_3_452.mol2 | 2v12 | 0.803922 | -6.58 | c1(ccccc1C(=O)NC)O | 11 |
| 4ngp_ligand_3_514.mol2 | 4ngp | 0.803922 | -6.23 | CNC(=O)c1c(cccc1)O | 11 |
| 1yms_ligand_3_6.mol2 | 1yms | 0.788462 | -6.88 | CNC(=O)c1c(ccc2c1cccc2)O | 15 |
| 1ny0_ligand_3_6.mol2 | 1ny0 | 0.788462 | -6.44 | CNC(=O)c1c(ccc2c1cccc2)O | 15 |
| 2v12_ligand_4_2059.mol2 | 2v12 | 0.745455 | -6.86 | CCNC(=O)c1c(cccc1)O | 12 |
| 4ngp_ligand_4_2511.mol2 | 4ngp | 0.745455 | -6.50 | CCNC(=O)c1c(cccc1)O | 12 |
| 2v13_ligand_4_1379.mol2 | 2v13 | 0.724138 | -6.64 | COc1ccccc1C(=O)NC | 12 |
104 ,
11
