ID | 3111 |
Name | Roemerine |
Pubchem ID | 119204 |
KEGG ID | N/A |
Source | Hornschuchia obliqua |
Type | Natural |
Function | Adrenergic alpha-blocker |
Drug Like Properties | Yes |
Molecular Weight | 279.33 |
Exact mass | 279.125929 |
Molecular formula | C18H17NO2 |
XlogP | 3.3 |
Topological Polar Surface Area | 21.7 |
H-Bond Donor | 0 |
H-Bond Acceptor | 3 |
Rotational Bond Count | 0 |
IUPAC Name | N/A |
Structure | |
SDF file | |
MOL file | |
PDB file | |
Canonical SMILE | CN1CCC2=CC3=C(C4=C2C1CC5=CC=CC=C54)OCO3 |
Isomeric SMILE | CN1CCC2=CC3=C(C4=C2[C@H]1CC5=CC=CC=C54)OCO3 |
Drugpedia | wiki |
References | 1. Source 2. Function 3. All Records |