| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | Yes |
Popular Name: (2S)-2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-1-piperazin-1-yl-propan-1-one (2S)-2-[(3S)-3-(dimethylamino)py…
| 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) | -0.53 | 2.77 | -90.97 | 3 | 5 | 2 | 45 | 256.394 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.53 | -0.95 | -8.53 | 1 | 5 | 0 | 39 | 254.378 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.53 | 1.44 | -39.94 | 2 | 5 | 1 | 40 | 255.386 | 3 | ↓ |
