In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 25th, 2008 | 29 | 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) | -1.02 | 10.92 | -37.26 | 1 | 7 | 1 | 59 | 402.563 | 7 | ↓ |
Mid Mid (pH 6-8) | -1.02 | 13.24 | -111.79 | 2 | 7 | 2 | 60 | 403.571 | 7 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
5HT4R-1-E | Serotonin 4 (5-HT4) Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 66 | 0.35 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
5HT4R_HUMAN | Q13639 | Serotonin 4 (5-HT4) Receptor, Human | 66.3 | 0.35 | Binding ≤ 1μM |
5HT4R_HUMAN | Q13639 | Serotonin 4 (5-HT4) Receptor, Human | 66.3 | 0.35 | Binding ≤ 10μM |
Description | Species |
---|---|
G alpha (s) signalling events | |
Serotonin receptors |