Common name
methanethioic S-acid
IUPAC name
methanethioic S-acid
SMILES
SC=O
Common name
methanethioic S-acid
IUPAC name
methanethioic S-acid
SMILES
SC=O
INCHI
InChI=1S/CH2OS/c2-1-3/h1H,(H,2,3)
FORMULA
CH2OS
Common name
methanethioic S-acid
IUPAC name
methanethioic S-acid
Molecular weight
62.091
clogP
0.525
clogS
0.229
Frequency
0.0017
HBond Acceptor
1
HBond Donor
1
Total PolarSurface Area
55.87
Number of Rings
0
Rotatable Bond
0
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD00453 | Fluticasone Propionate |
|
Anti-Allergic Agents; Anti-Inflammatory Agents; Dermatologic Agents; Bronchodilator Agents; Glucocorticoids; Corticosteroids; Respiratory System; Drugs for Obstructive Airway Diseases; Dermatologicals; Nasal Preparations; Adrenergics, Inhalants; Corticosteroids, Potent (Group III); Corticosteroids, Plain; Corticosteroids, Dermatological Preparations; CYP3A4 Inhibitors; | Fluticasone propionate, a medium-potency synthetic corticosteroid, is used topically to relieve inflammatory and pruritic symptoms of dermatoses and psoriasis, intranasally to manage symptoms of allergic and non-allergic rhinitis, and orally for the maintenance treatment of asthma as prophylactic therapy and for patients requiring oral corticosteroid therapy for asthma. |
| FDBD01198 | Stepronin |
|
Antiviral Agents; Immunosuppressive Agents; Expectorants; Mucolytics; Cough and Cold Preparations; Respiratory System; | Strepronin is a mucolytic (expectorant) drug. |
| FDBD01567 | Fluticasone furoate |
|
Fluticasone furoate nasal spray is indicated for the treatment of the symptoms of seasonal and perennial allergic rhinitis in patients aged 2 years and older. | |
| FDBD02624 | MCPA-thioethyl |
|
Herbicide | Herbicide |
| FDBD03238 | acibenzolar |
|
Fungicide | Fungicide |
5 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 2ha7_ligand_frag_2.mol2 | 2ha7 | 1 | -5.33 | C(=O)S | 3 |
| 2ha7_ligand_1_2.mol2 | 2ha7 | 0.666667 | -5.26 | C(=O)SC | 4 |
| 3irx_ligand_frag_0.mol2 | 3irx | 0.666667 | -5.23 | O=CSC | 4 |
| 2oax_ligand_frag_1.mol2 | 2oax | 0.571429 | -5.77 | C(=O)(S)C | 4 |
| 2ha5_ligand_frag_3.mol2 | 2ha5 | 0.571429 | -5.70 | C(=O)(S)C | 4 |
| 2ha7_ligand_1_1.mol2 | 2ha7 | 0.571429 | -5.69 | C(=O)(S)C | 4 |
| 2ha5_ligand_1_2.mol2 | 2ha5 | 0.4 | -5.64 | CSC(=O)C | 5 |
| 2ha7_ligand_2_4.mol2 | 2ha7 | 0.4 | -5.61 | C(=O)(SC)C | 5 |
| 4ega_ligand_1_2.mol2 | 4ega | 0.4 | -5.61 | S(C)C | 3 |
189 ,
19
