In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2009 | 38 | Yes |
None
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) | 5.87 | 14.54 | -49.84 | 0 | 8 | -1 | 97 | 505.602 | 8 | ↓ |
Lo Low (pH 4.5-6) | 5.87 | 14.56 | -14.77 | 1 | 8 | 0 | 99 | 506.61 | 8 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
AGTR2-1-E | Angiotensin II Type 2 (AT-2) Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 11 | 0.29 | Functional ≤ 10μM |
AGTRA-1-E | Angiotensin II Type 1a (AT-1a) Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 11 | 0.29 | Functional ≤ 10μM |
AGTRB-1-E | Angiotensin II Type 1b (AT-1b) Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 11 | 0.29 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
AGTRA_RAT | P25095 | Angiotensin II Type 1a (AT-1a) Receptor, Rat | 11 | 0.29 | Functional ≤ 10μM |
AGTRB_RAT | P29089 | Angiotensin II Type 1b (AT-1b) Receptor, Rat | 11 | 0.29 | Functional ≤ 10μM |
AGTR2_RAT | P35351 | Angiotensin II Type 2 (AT-2) Receptor, Rat | 11 | 0.29 | Functional ≤ 10μM |
Description | Species |
---|---|
G alpha (i) signalling events | |
G alpha (q) signalling events | |
Peptide ligand-binding receptors |