| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2008 | 18 | Yes |
Popular Name: (1S)-N,N-diethyl-N'-isobutyl-1-phenyl-ethane-1,2-diamine (1S)-N,N-diethyl-N'-isobutyl-1-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) | 3.23 | 9.73 | -116.39 | 3 | 2 | 2 | 21 | 250.43 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.23 | 7.79 | -30.09 | 2 | 2 | 1 | 16 | 249.422 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.23 | 6.51 | -0.78 | 1 | 2 | 0 | 15 | 248.414 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.23 | 7.91 | -36.7 | 2 | 2 | 1 | 20 | 249.422 | 8 | ↓ |
