| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2008 | 18 | Yes |
Popular Name: (1S)-N-butyl-N-ethyl-1-(4-ethylphenyl)ethane-1,2-diamine (1S)-N-butyl-N-ethyl-1-(4-ethylp…
| 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) | 3.46 | 8.4 | -117.13 | 4 | 2 | 2 | 32 | 250.43 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.46 | 6.5 | -44.24 | 3 | 2 | 1 | 31 | 249.422 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.46 | 8.03 | -32.82 | 3 | 2 | 1 | 30 | 249.422 | 8 | ↓ |
