| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 23rd, 2008 | 25 | No |
Popular Name: LS-192336 LS-192336
| 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) | 6.57 | 14.77 | -7.22 | 0 | 2 | 0 | 26 | 370.489 | 16 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| CNR1-2-E | Cannabinoid CB1 Receptor (cluster #2 Of 5), Eukaryotic | Eukaryotes | 530 | 0.35 | Binding ≤ 10μM |
| FAAH1-3-E | Anandamide Amidohydrolase (cluster #3 Of 7), Eukaryotic | Eukaryotes | 23 | 0.43 | Binding ≤ 10μM |
| MGLL-1-E | Monoglyceride Lipase (cluster #1 Of 7), Eukaryotic | Eukaryotes | 26 | 0.42 | Binding ≤ 10μM |
| PA24A-1-E | Cytosolic Phospholipase A2 (cluster #1 Of 3), Eukaryotic | Eukaryotes | 640 | 0.35 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| FAAH1_MOUSE | O08914 | Anandamide Amidohydrolase, Mouse | 0.1 | 0.56 | Binding ≤ 1μM |
| FAAH1_HUMAN | O00519 | Anandamide Amidohydrolase, Human | 0.33 | 0.53 | Binding ≤ 1μM |
| FAAH1_RAT | P97612 | Anandamide Amidohydrolase, Rat | 2.5 | 0.48 | Binding ≤ 1μM |
| CNR1_MOUSE | P47746 | Cannabinoid CB1 Receptor, Mouse | 530 | 0.35 | Binding ≤ 1μM |
| CNR1_RAT | P20272 | Cannabinoid CB1 Receptor, Rat | 20 | 0.43 | Binding ≤ 1μM |
| PA24A_HUMAN | P47712 | Cytosolic Phospholipase A2, Human | 640 | 0.35 | Binding ≤ 1μM |
| MGLL_HUMAN | Q99685 | Monoglyceride Lipase, Human | 26.3 | 0.42 | Binding ≤ 1μM |
| FAAH1_HUMAN | O00519 | Anandamide Amidohydrolase, Human | 0.33 | 0.53 | Binding ≤ 10μM |
| FAAH1_RAT | P97612 | Anandamide Amidohydrolase, Rat | 2.5 | 0.48 | Binding ≤ 10μM |
| FAAH1_MOUSE | O08914 | Anandamide Amidohydrolase, Mouse | 0.1 | 0.56 | Binding ≤ 10μM |
| CNR1_MOUSE | P47746 | Cannabinoid CB1 Receptor, Mouse | 530 | 0.35 | Binding ≤ 10μM |
| CNR1_RAT | P20272 | Cannabinoid CB1 Receptor, Rat | 20 | 0.43 | Binding ≤ 10μM |
| PA24A_HUMAN | P47712 | Cytosolic Phospholipase A2, Human | 640 | 0.35 | Binding ≤ 10μM |
| MGLL_HUMAN | Q99685 | Monoglyceride Lipase, Human | 26.3 | 0.42 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Acyl chain remodeling of CL | |
| Acyl chain remodeling of DAG and TAG | |
| Acyl chain remodelling of PC | |
| Acyl chain remodelling of PE | |
| Acyl chain remodelling of PG | |
| Acyl chain remodelling of PI | |
| Acyl chain remodelling of PS | |
| ADP signalling through P2Y purinoceptor 1 | |
| Arachidonate production from DAG | |
| Arachidonic acid metabolism | |
| Class A/1 (Rhodopsin-like receptors) | |
| G alpha (i) signalling events | |
| Hormone-sensitive lipase (HSL)-mediated triacylglycerol hydrolysis | |
| Hydrolysis of LPC | |
| phospho-PLA2 pathway | |
| Platelet sensitization by LDL | |
| Synthesis of PA |
No pre-computed analogs available. Try a structural similarity search.