| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 27th, 2010 | 18 | Yes |
Popular Name: (2S)-3-[(5-bromo-2-methoxy-phenyl)methyl-ethyl-amino]-2-methyl-propanenitrile (2S)-3-[(5-bromo-2-methoxy-pheny…
| 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) | 3.44 | 8.51 | -42.95 | 1 | 3 | 1 | 37 | 312.231 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.44 | 6.66 | -5.87 | 0 | 3 | 0 | 36 | 311.223 | 6 | ↓ |
