Common name
methoxyazanium
IUPAC name
methoxyazanium
SMILES
[H][N]([H])([H])OC
Common name
methoxyazanium
IUPAC name
methoxyazanium
SMILES
[H][N]([H])([H])OC
INCHI
InChI=1S/CH6NO/c1-3-2/h1-2H3/q+1
FORMULA
CH6NO
Common name
methoxyazanium
IUPAC name
methoxyazanium
Molecular weight
48.064
clogP
-0.503
clogS
0.155
Frequency
0.0003
HBond Acceptor
1
HBond Donor
3
Total PolarSurface Area
36.87
Number of Rings
0
Rotatable Bond
0
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD02336 | fluxametamide |
|
Insecticide | Insecticide |
1 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 2on3_ligand_1_2.mol2 | 2on3 | 1 | -5.36 | CO[NH3+] | 3 |
| 3dz5_ligand_1_0.mol2 | 3dz5 | 1 | -5.23 | [NH3+]OC | 3 |
| 1i72_ligand_1_0.mol2 | 1i72 | 1 | -5.22 | CO[NH3+] | 3 |
| 3dz6_ligand_1_0.mol2 | 3dz6 | 1 | -5.12 | CO[NH3+] | 3 |
| 4czs_ligand_1_0.mol2 | 4czs | 1 | -4.91 | CO[NH3+] | 3 |
| 2on3_ligand_2_2.mol2 | 2on3 | 0.5 | -5.68 | CCO[NH3+] | 4 |
| 3dz5_ligand_2_0.mol2 | 3dz5 | 0.5 | -5.55 | CCO[NH3+] | 4 |
| 1i72_ligand_2_0.mol2 | 1i72 | 0.5 | -5.52 | C(O[NH3+])C | 4 |
| 3dz6_ligand_2_6.mol2 | 3dz6 | 0.5 | -5.43 | C(C)O[NH3+] | 4 |
| 4mm9_ligand_2_39.mol2 | 4mm9 | 0.5 | -5.23 | CO[NH2+]C | 4 |
287 ,
29
