| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2008 | 28 | Yes |
Popular Name: 6-amino-2-[4-(2-butylamino-2-oxo-ethyl)piperazin-1-yl]quinoline-4-carboxylic 6-amino-2-[4-(2-butylamino-2-oxo…
| 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) | 2.18 | 5.59 | -42.13 | 4 | 8 | 0 | 116 | 385.468 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.18 | 3.08 | -64.66 | 3 | 8 | -1 | 115 | 384.46 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.18 | 5.57 | -108.52 | 5 | 8 | 1 | 117 | 386.476 | 7 | ↓ |
