| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 17 | Yes |
Popular Name: (2S)-2-amino-N-[(4-bromo-2-thienyl)methyl]-N-methyl-butanediamide (2S)-2-amino-N-[(4-bromo-2-thien…
| 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) | 0.79 | 0.28 | -39.42 | 5 | 5 | 1 | 91 | 321.22 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.79 | -0.05 | -11.49 | 4 | 5 | 0 | 89 | 320.212 | 5 | ↓ |
