| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2009 | 23 | No |
Popular Name: DNC008501 DNC008501
None
| 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) | 6.01 | 10.39 | -9.51 | 1 | 5 | 0 | 75 | 315.369 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.01 | 11.33 | -41.97 | 0 | 5 | -1 | 78 | 314.361 | 8 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| INHA-4-B | Enoyl-[acyl-carrier-protein] Reductase (cluster #4 Of 4), Bacterial | Bacteria | 90 | 0.43 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| INHA_MYCTU | P0A5Y6 | Enoyl-[acyl-carrier-protein] Reductase, Myctu | 1 | 0.55 | Binding ≤ 1μM |
| INHA_MYCTU | P0A5Y6 | Enoyl-[acyl-carrier-protein] Reductase, Myctu | 1 | 0.55 | Binding ≤ 10μM |
