| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2008 | 20 | Yes |
Popular Name: (1S)-N-butyl-N-ethyl-1-(4-propoxyphenyl)ethane-1,2-diamine (1S)-N-butyl-N-ethyl-1-(4-propox…
| 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) | 2.21 | 8.61 | -36.03 | 3 | 3 | 1 | 40 | 279.448 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 8.9 | -133.41 | 4 | 3 | 2 | 41 | 280.456 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 7.02 | -45.04 | 3 | 3 | 1 | 40 | 279.448 | 10 | ↓ |
