| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 14 | Yes |
Popular Name: N-[(1S)-1-(5-bromo-2-thienyl)ethyl]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) | 2.23 | 4.55 | -103.12 | 5 | 2 | 2 | 44 | 279.247 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.23 | 3.33 | -42.5 | 4 | 2 | 1 | 40 | 278.239 | 6 | ↓ |
