| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 25 | No |
Popular Name: 2-nitro-5-piperazin-1-yl-N-[(Z)-quinuclidin-3-ylideneamino]aniline 2-nitro-5-piperazin-1-yl-N-[(Z)-…
| 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) | 3.19 | 5.52 | -54.18 | 3 | 8 | 1 | 93 | 345.427 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.19 | 4.22 | -8.17 | 2 | 8 | 0 | 89 | 344.419 | 4 | ↓ |
