| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2005 | 33 | No |
Popular Name: CCOC(=O)[C@H](C)NP(=O)(c1ccc(o1)c2c(sc(n2)N)CC(C)C)N[C@@H](C)C(=O)OCC CCOC(=O)[C@H](C)NP(=O)(c1ccc(o1)…
| 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) | 3.06 | -1.27 | -18.43 | 4 | 10 | 0 | 145 | 500.558 | 14 | ↓ |
| Lo Low (pH 4.5-6) | 3.06 | -1.18 | -39.19 | 5 | 10 | 1 | 147 | 501.566 | 14 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| F16P1-1-E | Fructose-1,6-bisphosphatase 1 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 10 | 0.34 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| F16P1_HUMAN | P09467 | Fructose-1,6-bisphosphatase, Human | 10 | 0.34 | Binding ≤ 1μM |
| F16P1_HUMAN | P09467 | Fructose-1,6-bisphosphatase, Human | 10 | 0.34 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Gluconeogenesis |
