| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 17 | Yes |
Popular Name: (2S)-N2-ethyl-N2-isobutyl-3-phenyl-propane-1,2-diamine (2S)-N2-ethyl-N2-isobutyl-3-phen…
| 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) | 2.44 | 6.2 | -43.86 | 3 | 2 | 1 | 31 | 235.395 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.44 | 6.08 | -1.57 | 2 | 2 | 0 | 29 | 234.387 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.44 | 6.96 | -28.26 | 3 | 2 | 1 | 30 | 235.395 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.44 | 7.33 | -121 | 4 | 2 | 2 | 32 | 236.403 | 7 | ↓ |
