In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 8th, 2009 | 19 | Yes |
Popular Name: ethyl ethyl
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) | 3.03 | 9.96 | -36.9 | 1 | 3 | 1 | 31 | 262.373 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.03 | 7.61 | -5.04 | 0 | 3 | 0 | 30 | 261.365 | 5 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
OPRD-1-E | Delta Opioid Receptor (cluster #1 Of 3), Eukaryotic | Eukaryotes | 5000 | 0.39 | Binding ≤ 10μM |
OPRK-3-E | Kappa Opioid Receptor (cluster #3 Of 6), Eukaryotic | Eukaryotes | 5000 | 0.39 | Binding ≤ 10μM |
OPRM-1-E | Mu-type Opioid Receptor (cluster #1 Of 4), Eukaryotic | Eukaryotes | 5000 | 0.39 | Binding ≤ 10μM |
SGMR1-1-E | Sigma Opioid Receptor (cluster #1 Of 6), Eukaryotic | Eukaryotes | 5000 | 0.39 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
OPRD_HUMAN | P41143 | Delta Opioid Receptor, Human | 5000 | 0.39 | Binding ≤ 10μM |
OPRD_MOUSE | P32300 | Delta Opioid Receptor, Mouse | 5000 | 0.39 | Binding ≤ 10μM |
OPRK_HUMAN | P41145 | Kappa Opioid Receptor, Human | 5000 | 0.39 | Binding ≤ 10μM |
OPRK_MOUSE | P33534 | Kappa Opioid Receptor, Mouse | 5000 | 0.39 | Binding ≤ 10μM |
OPRM_MOUSE | P42866 | Mu Opioid Receptor, Mouse | 5000 | 0.39 | Binding ≤ 10μM |
OPRM_HUMAN | P35372 | Mu Opioid Receptor, Human | 5000 | 0.39 | Binding ≤ 10μM |
SGMR1_HUMAN | Q99720 | Sigma Opioid Receptor, Human | 5000 | 0.39 | Binding ≤ 10μM |
SGMR1_MOUSE | O55242 | Sigma Opioid Receptor, Mouse | 5000 | 0.39 | Binding ≤ 10μM |
Description | Species |
---|---|
G alpha (i) signalling events | |
G-protein activation | |
Opioid Signalling | |
Peptide ligand-binding receptors |