| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 17 | No |
Popular Name: (2S)-3-[(3-bromo-4-fluoro-phenyl)methyl-methyl-amino]-2-methyl-propanethioamide (2S)-3-[(3-bromo-4-fluoro-phenyl…
| 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) | 2.30 | 7.45 | -48.5 | 3 | 2 | 1 | 30 | 320.251 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 5.4 | -8.71 | 2 | 2 | 0 | 29 | 319.243 | 5 | ↓ |
