| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 22 | Yes |
Popular Name: LS-193308 LS-193308
None
| 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) | 4.34 | 11.3 | -30.01 | 1 | 3 | 1 | 31 | 302.438 | 4 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| SC6A2-1-E | Norepinephrine Transporter (cluster #1 Of 2), Eukaryotic | Eukaryotes | 52 | 0.46 | Binding ≤ 10μM |
| SC6A3-1-E | Dopamine Transporter (cluster #1 Of 3), Eukaryotic | Eukaryotes | 1 | 0.57 | Binding ≤ 10μM |
| SC6A4-4-E | Serotonin Transporter (cluster #4 Of 4), Eukaryotic | Eukaryotes | 2830 | 0.35 | Binding ≤ 10μM |
| ACHA3-2-E | Neuronal Acetylcholine Receptor Protein Alpha-3 Subunit (cluster #2 Of 3), Eukaryotic | Eukaryotes | 1800 | 0.37 | Functional ≤ 10μM |
| ACHB2-1-E | Neuronal Acetylcholine Receptor Protein Beta-2 Subunit (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1800 | 0.37 | Functional ≤ 10μM |
| ACHB4-1-E | Neuronal Acetylcholine Receptor Protein Beta-4 Subunit (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1800 | 0.37 | Functional ≤ 10μM |
| ITA5-1-E | Fibronectin Receptor Alpha (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1800 | 0.37 | Functional ≤ 10μM |
| Z104285-1-O | Neuronal Acetylcholine Receptor; Alpha4/beta4 (cluster #1 Of 1), Other | Other | 8800 | 0.32 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| SC6A3_HUMAN | Q01959 | Dopamine Transporter, Human | 0.83 | 0.58 | Binding ≤ 1μM |
| SC6A2_HUMAN | P23975 | Norepinephrine Transporter, Human | 52 | 0.46 | Binding ≤ 1μM |
| SC6A3_HUMAN | Q01959 | Dopamine Transporter, Human | 0.83 | 0.58 | Binding ≤ 10μM |
| SC6A2_HUMAN | P23975 | Norepinephrine Transporter, Human | 52 | 0.46 | Binding ≤ 10μM |
| SC6A4_HUMAN | P31645 | Serotonin Transporter, Human | 2830 | 0.35 | Binding ≤ 10μM |
| ITA5_HUMAN | P08648 | Fibronectin Receptor Alpha, Human | 1800 | 0.37 | Functional ≤ 10μM |
| ACHA3_HUMAN | P32297 | Neuronal Acetylcholine Receptor Protein Alpha-3 Subunit, Human | 1800 | 0.37 | Functional ≤ 10μM |
| ACHB2_HUMAN | P17787 | Neuronal Acetylcholine Receptor Protein Beta-2 Subunit, Human | 1800 | 0.37 | Functional ≤ 10μM |
| ACHB4_HUMAN | P30926 | Neuronal Acetylcholine Receptor Protein Beta-4 Subunit, Human | 1800 | 0.37 | Functional ≤ 10μM |
| Z104285 | Z104285 | Neuronal Acetylcholine Receptor; Alpha4/beta4 | 8800 | 0.32 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| Cell surface interactions at the vascular wall | |
| Dopamine clearance from the synaptic cleft | |
| Elastic fibre formation | |
| Fibronectin matrix formation | |
| Highly calcium permeable nicotinic acetylcholine receptors | |
| Highly calcium permeable postsynaptic nicotinic acetylcholine receptors | |
| Highly sodium permeable acetylcholine nicotinic receptors | |
| Integrin cell surface interactions | |
| Na+/Cl- dependent neurotransmitter transporters | |
| Signal transduction by L1 |
