| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 18 | Yes |
Popular Name: (1S)-N-butyl-N-ethyl-1-(4-methoxyphenyl)ethane-1,2-diamine (1S)-N-butyl-N-ethyl-1-(4-methox…
| 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) | 1.33 | 6.9 | -36.24 | 3 | 3 | 1 | 40 | 251.394 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.33 | 7.19 | -133.21 | 4 | 3 | 2 | 41 | 252.402 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.33 | 5.31 | -45.18 | 3 | 3 | 1 | 40 | 251.394 | 8 | ↓ |
