| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 16 | Yes |
Popular Name: N-[(1S)-1-(5-bromo-2-thienyl)ethyl]-N',N'-dimethyl-butane-1,4-diamine N-[(1S)-1-(5-bromo-2-thienyl)eth…
| 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 | 8.48 | -96.65 | 3 | 2 | 2 | 21 | 307.301 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.46 | 7.25 | -34.53 | 2 | 2 | 1 | 16 | 306.293 | 7 | ↓ |
