| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 30th, 2010 | 14 | Yes |
Popular Name: N-[3-(4-methylpiperazin-1-yl)propyl]ethane-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) | -1.26 | 1.1 | -173.58 | 6 | 4 | 3 | 52 | 203.354 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.26 | -1.64 | -38.48 | 4 | 4 | 1 | 49 | 201.338 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.26 | -2.6 | -41.84 | 4 | 4 | 1 | 46 | 201.338 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.26 | 0.73 | -84.16 | 5 | 4 | 2 | 50 | 202.346 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.26 | -0.22 | -82.25 | 5 | 4 | 2 | 47 | 202.346 | 6 | ↓ |
