| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 18 | Yes |
Popular Name: N-isobutyl-N',N'-dimethyl-N-(2-piperazin-1-ylethyl)ethane-1,2-diamine N-isobutyl-N',N'-dimethyl-N-(2-p…
| 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) | 0.82 | 4.41 | -80.45 | 3 | 4 | 2 | 28 | 258.454 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.82 | 1.75 | -37.64 | 2 | 4 | 1 | 26 | 257.446 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.82 | 3.34 | -88.74 | 3 | 4 | 2 | 28 | 258.454 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 0.82 | 5.8 | -173.44 | 4 | 4 | 3 | 29 | 259.462 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 0.82 | 6.47 | -182.18 | 4 | 4 | 3 | 29 | 259.462 | 8 | ↓ |
