Common name
4-methoxy-2-methyl-pyridine
IUPAC name
4-methoxy-2-methyl-pyridine
SMILES
O(C)c1cc(ncc1)C
Common name
4-methoxy-2-methyl-pyridine
IUPAC name
4-methoxy-2-methyl-pyridine
SMILES
O(C)c1cc(ncc1)C
INCHI
InChI=1S/C7H9NO/c1-6-5-7(9-2)3-4-8-6/h3-5H,1-2H3
FORMULA
C7H9NO
Common name
4-methoxy-2-methyl-pyridine
IUPAC name
4-methoxy-2-methyl-pyridine
Molecular weight
123.152
clogP
1.799
clogS
-2.040
Frequency
0.0003
HBond Acceptor
2
HBond Donor
0
Total PolarSurface Area
22.12
Number of Rings
1
Rotatable Bond
1
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD00101 | Pantoprazole |
|
Anti-Ulcer Agents; Proton Pump Inhibitors; Alimentary Tract and Metabolism; Drugs for Peptic Ulcer and Gastro-Oesophageal Reflux Disease (Gord); Drugs for Acid Related Disorders; Cytochrome P-450 CYP1A2 Inhibitors; Cytochrome P-450 CYP2C9 Inhibitors; Cytochrome P-450 CYP1A2 Inducers; Cytochrome P-450 CYP2C9 Inducers; Cytochrome P-450 CYP2C19 Inducers; CYP3A4 Inhibitors; | Short-term (up to 16 weeks) treatment of erosive esophagitis. |
1 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 4p7s_ligand_1_2.mol2 | 4p7s | 0.853659 | -5.27 | Oc1ccnc(c1)C | 8 |
| 4p7m_ligand_2_0.mol2 | 4p7m | 0.732143 | -6.85 | c1c(cccc1Oc1ccnc(c1)C)O | 15 |
111 ,
12
