Common name
N-(ethoxymethyl)formamide
IUPAC name
N-(ethoxymethyl)formamide
SMILES
C(NC=O)OCC
Common name
N-(ethoxymethyl)formamide
IUPAC name
N-(ethoxymethyl)formamide
SMILES
C(NC=O)OCC
INCHI
InChI=1S/C4H9NO2/c1-2-7-4-5-3-6/h3H,2,4H2,1H3,(H,5,6)
FORMULA
C4H9NO2
Common name
N-(ethoxymethyl)formamide
IUPAC name
N-(ethoxymethyl)formamide
Molecular weight
103.120
clogP
-0.192
clogS
-0.744
Frequency
0.0014
HBond Acceptor
2
HBond Donor
1
Total PolarSurface Area
38.33
Number of Rings
0
Rotatable Bond
3
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD02406 | acetochlor |
|
Herbicide | Herbicide |
| FDBD02409 | butachlor |
|
Herbicide | Herbicide |
| FDBD02413 | ethachlor |
|
Herbicide | Herbicide |
| FDBD02422 | terbuchlor |
|
Herbicide | Herbicide |
4 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 2aux_ligand_3_64.mol2 | 2aux | 0.727273 | -5.60 | CNC(=O)OCC | 7 |
| 4djo_ligand_3_439.mol2 | 4djo | 0.727273 | -5.59 | CNC(=O)OCC | 7 |
| 1yt7_ligand_3_143.mol2 | 1yt7 | 0.727273 | -5.55 | CNC(=O)OCC | 7 |
| 4djq_ligand_3_357.mol2 | 4djq | 0.727273 | -5.52 | CCOC(=O)NC | 7 |
| 3hhu_ligand_2_0.mol2 | 3hhu | 0.727273 | -5.36 | CCOC(=O)NC | 7 |
| 2fs9_ligand_2_39.mol2 | 2fs9 | 0.727273 | -5.35 | CNC(=O)OCC | 7 |
| 1a7x_ligand_3_97.mol2 | 1a7x | 0.727273 | -5.09 | C(C)OC(=O)NC | 7 |
| 1zsr_ligand_2_0.mol2 | 1zsr | 0.695652 | -6.54 | CNC(=O)OC(C)(C)C | 9 |
| 1zsf_ligand_2_0.mol2 | 1zsf | 0.695652 | -6.53 | CNC(=O)OC(C)(C)C | 9 |
109 ,
11
