Common name
(3-methoxyphenyl)methanol
IUPAC name
(3-methoxyphenyl)methanol
SMILES
C(O)c1cccc(c1)OC
Common name
(3-methoxyphenyl)methanol
IUPAC name
(3-methoxyphenyl)methanol
SMILES
C(O)c1cccc(c1)OC
INCHI
InChI=1S/C8H10O2/c1-10-8-4-2-3-7(5-8)6-9/h2-5,9H,6H2,1H3
FORMULA
C8H10O2
Common name
(3-methoxyphenyl)methanol
IUPAC name
(3-methoxyphenyl)methanol
Molecular weight
138.164
clogP
1.672
clogS
-1.720
Frequency
0.0007
HBond Acceptor
2
HBond Donor
1
Total PolarSurface Area
29.46
Number of Rings
1
Rotatable Bond
2
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD00099 | Midodrine |
|
Vasoconstrictor Agents; Sympathomimetics; Adrenergic alpha-1 Receptor Agonists; Cardiovascular System; Cardiac Therapy; Adrenergic and Dopaminergic Agents; Cardiac Stimulants Excl. Cardiac Glycosides; CYP2D6 Inducers; CYP2D6 Inducers (strong); | For the treatment of symptomatic orthostatic hypotension (OH). |
| FDBD00587 | Methoxamine |
|
Vasoconstrictor Agents; Sympathomimetics; Adrenergic alpha-1 Receptor Agonists; Cardiovascular System; Cardiac Therapy; Adrenergic and Dopaminergic Agents; Cardiac Stimulants Excl. Cardiac Glycosides; | Indicated for the treatment and management of hypotension. |
2 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 4eh8_ligand_3_3.mol2 | 4eh8 | 1 | -6.77 | COc1cc(ccc1)CO | 10 |
| 4h38_ligand_4_285.mol2 | 4h38 | 1 | -6.62 | O(c1cc(ccc1)CO)C | 10 |
| 3gz9_ligand_4_299.mol2 | 3gz9 | 1 | -6.29 | O(c1cccc(c1)CO)C | 10 |
| 3h0a_ligand_4_284.mol2 | 3h0a | 1 | -6.29 | OCc1cccc(OC)c1 | 10 |
154 ,
16
