Substance Information
| In ZINC since |
Heavy atoms |
Benign functionality |
| October 27th, 2004 |
23 |
Yes
|
Other Names:
1,10-Dimethoxy-6a-alpha-noraporphine-2,9-diol; 4H-Dibenzo(de,g)quinoline-2,9-diol, 5,6,6a,7-tetrahydro-1,10-dimethoxy-; 6a-alpha-Noraporphine-2,9-diol, 1,10-dimethoxy-; Dimethoxy-1,10 dihydroxy-2,9 nor-aporphine [French]; LS-97013; Laurolitsine; Norboldin
1,10-Dimethoxy-6a-alpha-noraporphine-2,9-diol; 4H-Dibenzo(de,g)quinoline-2,9-diol, 5,6,6a,7-tetrahydro-1,10-dimethoxy-; Dimethoxy-1,10 dihydroxy-2,9 nor-aporphine; Norboldine
1,10-Dimethoxy-6a-alpha-Noraporphine-2,9-diol;1,10-Dimethoxy-6a-alpha-noraporphine-2,9-diol;2,9-Dihydroxy-1,10-dimethoxynoraporphine;Dimethoxy-1,10 dihydroxy-2,9 nor-aporphine;Laurolistine;Laurolitsine;Norboldine
5890-18-6; C16984; Laurolitsine
laurolistine
Laurolitsine
NORBOLDINE
Download:
MOL2
SDF
SMILES
Flexibase
Physical Representations
|
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
|
Ref
Reference (pH 7)
|
2.22 |
-3.7 |
-55.44 |
4 |
5 |
1 |
75 |
314.361 |
2 |
↓
|
Clustered Target Annotations
| Code |
Organism Class |
Affinity (nM) |
LE (kcal/mol/atom) |
Type |
|
DRD1-1-E |
Dopamine D1 Receptor (cluster #1 Of 4), Eukaryotic |
Eukaryotes |
2500 |
0.34 |
Binding ≤ 10μM
|
|
DRD2-2-E |
Dopamine D2 Receptor (cluster #2 Of 24), Eukaryotic |
Eukaryotes |
6800 |
0.31 |
Binding ≤ 10μM
|
Reactome Annotations from Targets (via Uniprot)
| Description |
Species |
|
Dopamine receptors |
|
|
G alpha (i) signalling events |
|
No pre-computed analogs available. Try a structural similarity search.
