In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 28 | Yes |
Popular Name: methyl methyl
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) | 2.00 | 6.48 | -40.48 | 2 | 7 | 1 | 75 | 431.34 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.00 | 5.76 | -14.54 | 1 | 7 | 0 | 73 | 430.332 | 5 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
OPRK-1-E | Kappa Opioid Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 0 | 0.00 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
OPRK_HUMAN | P41145 | Kappa Opioid Receptor, Human | 0.34 | 0.47 | Functional ≤ 10μM |
Description | Species |
---|---|
G alpha (i) signalling events | |
Peptide ligand-binding receptors |