| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 30 | No |
Popular Name: NBTGR NBTGR
Find On: PubMed — Wikipedia — Google
CAS Numbers: 13153-27-0 , [13153-27-0]
| 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) | 0.81 | 1.94 | -19.74 | 5 | 12 | 0 | 185 | 434.434 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| S29A1-1-E | Equilibrative Nucleoside Transporter 1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1 | 0.42 | Binding ≤ 10μM |
| Z50425-15-O | Plasmodium Falciparum (cluster #15 Of 22), Other | Other | 10000 | 0.23 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| S29A1_HUMAN | Q99808 | Equilibrative Nucleoside Transporter 1, Human | 1.1 | 0.42 | Binding ≤ 1μM |
| S29A1_HUMAN | Q99808 | Equilibrative Nucleoside Transporter 1, Human | 1.1 | 0.42 | Binding ≤ 10μM |
| Z50425 | Z50425 | Plasmodium Falciparum | 10000 | 0.23 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| Transport of nucleosides and free purine and pyrimidine bases across the plasma |
