| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 17 | Yes |
Popular Name: (1S)-N'-isobutyl-N'-isopropyl-1-phenyl-ethane-1,2-diamine (1S)-N'-isobutyl-N'-isopropyl-1-…
| 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) | 1.25 | 7.62 | -33.05 | 3 | 2 | 1 | 30 | 235.395 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 6.18 | -1.22 | 2 | 2 | 0 | 29 | 234.387 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.25 | 7.87 | -122 | 4 | 2 | 2 | 32 | 236.403 | 6 | ↓ |
