| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2005 | 21 | No |
Popular Name: 1-(4-chlorophenyl)-2-(2-imino-3-methyl-benzoimidazol-1-yl)-ethanone 1-(4-chlorophenyl)-2-(2-imino-3-…
| 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) | -0.54 | 11.81 | -34.33 | 2 | 4 | 1 | 52 | 300.769 | 3 | ↓ |
| Ref Reference (pH 7) | -0.54 | 11.79 | -34.38 | 2 | 4 | 1 | 52 | 300.769 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| CXCR3-1-E | C-X-C Chemokine Receptor Type 3 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 800 | 0.41 | Binding ≤ 10μM |
| CXCR3-1-E | C-X-C Chemokine Receptor Type 3 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 9000 | 0.34 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| CXCR3_HUMAN | P49682 | C-X-C Chemokine Receptor Type 3, Human | 700 | 0.41 | Binding ≤ 1μM |
| CXCR3_HUMAN | P49682 | C-X-C Chemokine Receptor Type 3, Human | 700 | 0.41 | Binding ≤ 10μM |
| CXCR3_HUMAN | P49682 | C-X-C Chemokine Receptor Type 3, Human | 9000 | 0.34 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| Chemokine receptors bind chemokines | |
| G alpha (i) signalling events |
