| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 17 | Yes |
Popular Name: N'-[(1S)-1-(5-bromo-2-thienyl)ethyl]-N,N-diethyl-propane-1,3-diamine N'-[(1S)-1-(5-bromo-2-thienyl)et…
| 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) | 3.94 | 7.87 | -34.08 | 2 | 2 | 1 | 16 | 320.32 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.94 | 9.06 | -105.2 | 3 | 2 | 2 | 21 | 321.328 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.94 | 6.9 | -40.33 | 2 | 2 | 1 | 20 | 320.32 | 8 | ↓ |
