Common name
fluorophosphonic acid
IUPAC name
fluorophosphonic acid
SMILES
P(=O)(F)(O)O
Common name
fluorophosphonic acid
IUPAC name
fluorophosphonic acid
SMILES
P(=O)(F)(O)O
INCHI
InChI=1S/FH2O3P/c1-5(2,3)4/h(H2,2,3,4)
FORMULA
FH2O3P
Common name
fluorophosphonic acid
IUPAC name
fluorophosphonic acid
Molecular weight
99.986
clogP
-2.536
clogS
1.052
Frequency
0.0003
HBond Acceptor
3
HBond Donor
2
Total PolarSurface Area
57.53
Number of Rings
0
Rotatable Bond
0
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD00542 | Isoflurophate |
|
Cholinesterase Inhibitors; Protease Inhibitors; Anti-glaucoma Agents; Ophthalmics; | For use in the eye to treat certain types of glaucoma and other eye conditions, such as accommodative esotropia. |
1 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 3fzn_ligand_frag_0.mol2 | 3fzn | 0.444444 | -5.59 | P(=O)O | 3 |
| 4h4d_ligand_frag_2.mol2 | 4h4d | 0.444444 | -5.58 | P(=O)O | 3 |
| 4ko8_ligand_frag_1.mol2 | 4ko8 | 0.444444 | -5.52 | P(=O)O | 3 |
| 4pl0_ligand_frag_1.mol2 | 4pl0 | 0.444444 | -5.52 | P(=O)O | 3 |
| 1njf_ligand_frag_1.mol2 | 1njf | 0.444444 | -5.51 | P(=O)O | 3 |
| 4idn_ligand_frag_1.mol2 | 4idn | 0.444444 | -5.51 | P(=O)O | 3 |
| 1x07_ligand_frag_3.mol2 | 1x07 | 0.444444 | -5.50 | P(=O)O | 3 |
545 ,
55
