| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 17 | Yes |
Popular Name: (1S)-N-isopentyl-N',N'-dimethyl-1-phenyl-ethane-1,2-diamine (1S)-N-isopentyl-N',N'-dimethyl-…
| 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) | 3.36 | 9.39 | -114.06 | 3 | 2 | 2 | 21 | 236.403 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 7.01 | -40.52 | 2 | 2 | 1 | 20 | 235.395 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 8.18 | -31.68 | 2 | 2 | 1 | 16 | 235.395 | 7 | ↓ |
