| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2009 | 32 | Yes |
Popular Name: 1H-imidazol-4-ylmethyl 1H-imidazol-4-ylmethyl
| 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) | 4.42 | 7.78 | -22.94 | 4 | 8 | 0 | 112 | 431.496 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.42 | 8.34 | -43.24 | 5 | 8 | 1 | 113 | 432.504 | 10 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| NMBR-1-E | Neuromedin B Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 2600 | 0.24 | Binding ≤ 10μM |
| NMBR-1-E | Neuromedin B Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 2700 | 0.24 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| NMBR_HUMAN | P28336 | Neuromedin B Receptor, Human | 2600 | 0.24 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| G alpha (q) signalling events | |
| Peptide ligand-binding receptors |
