| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 7th, 2010 | 28 | No |
Popular Name: 4-(1-adamantyl)-N-(2-hydrazino-2-oxo-ethyl)quinoline-2-carboxamide 4-(1-adamantyl)-N-(2-hydrazino-2…
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) | 2.39 | 5.3 | -12.59 | 4 | 6 | 0 | 97 | 378.476 | 4 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50309-1-O | Mycobacterium Tuberculosis (cluster #1 Of 1), Other | Other | 7079 | 0.26 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50309 | Z50309 | Mycobacterium Tuberculosis | 7079.45784 | 0.26 | Functional ≤ 10μM |
