| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 20 | Yes |
Popular Name: (2S)-2-[4-[(1S)-1-methylpropyl]piperazin-1-yl]-1-piperazin-1-yl-propan-1-one (2S)-2-[4-[(1S)-1-methylpropyl]p…
| 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) | 0.42 | 4.34 | -88.78 | 3 | 5 | 2 | 45 | 284.448 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.42 | 1.25 | -7.42 | 1 | 5 | 0 | 39 | 282.432 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.42 | 3.08 | -35.77 | 2 | 5 | 1 | 40 | 283.44 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
