| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 20 | Yes |
Popular Name: (2S)-2-[4-(3-aminopropyl)piperazin-1-yl]-1-morpholino-propan-1-one (2S)-2-[4-(3-aminopropyl)piperaz…
| 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) | -1.16 | 1.27 | -94.39 | 4 | 6 | 2 | 65 | 286.42 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.16 | -1.22 | -8.89 | 2 | 6 | 0 | 62 | 284.404 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.16 | 1.04 | -39.9 | 3 | 6 | 1 | 63 | 285.412 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.16 | 1.42 | -112.65 | 4 | 6 | 2 | 65 | 286.42 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.16 | -0.85 | -50.32 | 3 | 6 | 1 | 64 | 285.412 | 5 | ↓ |
