| IPAD-DB ID | S00199 |
| Name | F2 |
| Category | Synthetic compounds |
| 2D Structure |
|
| 3D Structure | |
| Molecular Formula | F 2 |
| Molecular Weight | 37.99680633 g/mol |
| IUPAC Name | molecular fluorine |
| InChI | InChI=1S/F2/c1-2 |
| InChIKey | PXGOKWXKJXAPGV-UHFFFAOYSA-N |
| Canonical SMILES | FF |
| PubChem CID | 24524 |
| DrugBank Accession Number | - |
| CAS Registry Number | 7782-41-4 |
| Molecular Weight(Computed by SwissADME) | 38 |
| Hac(Computed by SwissADME) | 2 |
| Volume(Computed by ADMETlab 2.0) | |
| Density(Computed by ADMETlab 2.0) | |
| nRing(Computed by ADMETlab 2.0) | |
| MaxRing(Computed by ADMETlab 2.0) | |
| nHet(Computed by ADMETlab 2.0) | |
| fChar(Computed by ADMETlab 2.0) | |
| nRig(Computed by ADMETlab 2.0) | |
| Flexibility(Computed by ADMETlab 2.0) | |
| Stero Centers(Computed by ADMETlab 2.0) | |
| LogS(Computed by ADMETlab 2.0) | |
| LogD(Computed by ADMETlab 2.0) |
| logP(Computed by ADMETlab 2.0) | |
| TPSA(Computed by SwissADME) | 0 |
| Hbond Acceptor(Computed by SwissADME) | 6 |
| Hbond Donor(Computed by SwissADME) | 2 |
| Rotatable Bonds(Computed by SwissADME) | 0 |
| GI Absorption(Computed by SwissADME) | High |
| BBB(blood-brain barrier) Permeant(Computed by SwissADME) | No |
| P-gp Substrate(Computed by SwissADME) | Yes |
| CYP1A2 Inhibitor(Computed by SwissADME) | No |
| CYP2C19 Inhibitor(Computed by SwissADME) | Yes |
| CYP2C9 Inhibitor(Computed by SwissADME) | Yes |
| CYP2D6 Inhibitor(Computed by SwissADME) | Yes |
| CYP3A4 Inhibitor(Computed by SwissADME) | Yes |
| log Kp(Skin Permeation)(Computed by SwissADME) | -7.03 |
| Lipinski(Computed by SwissADME) | 0 |
| Ghose(Computed by SwissADME) | 1 |
| Veber(Computed by SwissADME) | 0 |
| Egan(Computed by SwissADME) | 0 |
| Muegge(Computed by SwissADME) | 0 |
| Bioavailability Score(Computed by SwissADME) | 0.55 |