| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 18 | Yes |
Popular Name: (2S)-N2-(2-dimethylaminoethyl)-3-ethyl-N2-isobutyl-pentane-1,2-diamine (2S)-N2-(2-dimethylaminoethyl)-3…
| 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) | 2.41 | 5.65 | -108.73 | 4 | 3 | 2 | 35 | 259.482 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.41 | 7.02 | -103.56 | 4 | 3 | 2 | 35 | 259.482 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.41 | 3.19 | -44.3 | 3 | 3 | 1 | 34 | 258.474 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 2.41 | 7.44 | -211.98 | 5 | 3 | 3 | 37 | 260.49 | 10 | ↓ |
