| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 18 | Yes |
Popular Name: 2-[4-(3-aminopropyl)piperazin-1-yl]-N-[(1S)-1-methylpropyl]acetamide 2-[4-(3-aminopropyl)piperazin-1-…
| 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) | 0.13 | 2.02 | -93.29 | 5 | 5 | 2 | 64 | 258.41 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.12 | -0.54 | -7.69 | 3 | 5 | 0 | 62 | 256.394 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.12 | 1.73 | -36.52 | 4 | 5 | 1 | 63 | 257.402 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.13 | 2.12 | -108.11 | 5 | 5 | 2 | 64 | 258.41 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.13 | -0.17 | -48.38 | 4 | 5 | 1 | 63 | 257.402 | 7 | ↓ |
