| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 30th, 2010 | 17 | Yes |
Popular Name: N-[3-(4-methylpiperazin-1-yl)propyl]-N'-propylethane-1,2-diamine N-[3-(4-methylpiperazin-1-yl)pro…
| 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) | 0.25 | 4.58 | -174.27 | 5 | 4 | 3 | 41 | 245.435 | 9 | ↓ |
| Hi High (pH 8-9.5) | 0.25 | 0.87 | -39.6 | 3 | 4 | 1 | 35 | 243.419 | 9 | ↓ |
| Hi High (pH 8-9.5) | 0.25 | 0.88 | -37.34 | 3 | 4 | 1 | 35 | 243.419 | 9 | ↓ |
| Mid Mid (pH 6-8) | 0.25 | 3.25 | -78.4 | 4 | 4 | 2 | 36 | 244.427 | 9 | ↓ |
| Mid Mid (pH 6-8) | 0.25 | 3.14 | -84.64 | 4 | 4 | 2 | 36 | 244.427 | 9 | ↓ |
| Mid Mid (pH 6-8) | 0.25 | 2.21 | -118.1 | 4 | 4 | 2 | 40 | 244.427 | 9 | ↓ |
