In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 8th, 2009 | 39 | No |
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) | 6.03 | 12.53 | -21.08 | 4 | 7 | 0 | 99 | 544.099 | 8 | ↓ |
Mid Mid (pH 6-8) | 6.03 | 12.83 | -42.18 | 5 | 7 | 1 | 100 | 545.107 | 8 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
GRPR-1-E | Gastrin Releasing Peptide Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 149 | 0.25 | Binding ≤ 10μM |
NMBR-1-E | Neuromedin B Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 3 | 0.31 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
GRPR_HUMAN | P30550 | Gastrin Releasing Peptide Receptor, Human | 149 | 0.25 | Binding ≤ 1μM |
GRPR_HUMAN | P30550 | Gastrin Releasing Peptide Receptor, Human | 149 | 0.25 | Binding ≤ 10μM |
NMBR_HUMAN | P28336 | Neuromedin B Receptor, Human | 2.8 | 0.31 | Functional ≤ 10μM |
Description | Species |
---|---|
G alpha (q) signalling events | |
Peptide ligand-binding receptors |