| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 26th, 2008 | 31 | Yes |
Popular Name: 5-methyl-2-propyl-3-[[4-[2-(1H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazo[5,4-b]pyridine 5-methyl-2-propyl-3-[[4-[2-(1H-t…
| 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) | 4.58 | 12.72 | -55.09 | 0 | 7 | -1 | 83 | 408.489 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.59 | 13.19 | -52.39 | 1 | 7 | 0 | 85 | 409.497 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.59 | 13.03 | -57.36 | 1 | 7 | 0 | 85 | 409.497 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.59 | 13.46 | -104.52 | 2 | 7 | 1 | 86 | 410.505 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.58 | 12.72 | -15.89 | 1 | 7 | 0 | 85 | 409.497 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| AGTR1-1-E | Type-1 Angiotensin II Receptor (cluster #1 Of 2), Eukaryotic | Eukaryotes | 2 | 0.39 | Binding ≤ 10μM |
| AGTR2-1-E | Angiotensin II Type 2 (AT-2) Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 2 | 0.39 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| AGTR1_HUMAN | P30556 | Angiotensin II Type 1 Receptor, Human | 2 | 0.39 | Binding ≤ 1μM |
| AGTR2_HUMAN | P50052 | Angiotensin II Type 2 (AT-2) Receptor, Human | 2 | 0.39 | Binding ≤ 1μM |
| AGTR1_HUMAN | P30556 | Angiotensin II Type 1 Receptor, Human | 2 | 0.39 | Binding ≤ 10μM |
| AGTR2_HUMAN | P50052 | Angiotensin II Type 2 (AT-2) Receptor, Human | 2 | 0.39 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| G alpha (i) signalling events | |
| G alpha (q) signalling events | |
| Peptide ligand-binding receptors |
