| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 17th, 2010 | 17 | Yes |
Popular Name: 2-[2-aminoethyl(isopropyl)amino]-1-(4-methylpiperazin-1-yl)ethanone 2-[2-aminoethyl(isopropyl)amino]…
| 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) | -0.94 | 0.98 | -34.16 | 3 | 5 | 1 | 54 | 243.375 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.94 | -0.38 | -43.19 | 3 | 5 | 1 | 54 | 243.375 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.94 | 1.98 | -90.75 | 4 | 5 | 2 | 56 | 244.383 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.94 | 3.72 | -184.13 | 5 | 5 | 3 | 57 | 245.391 | 5 | ↓ |
