| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 25th, 2010 | 17 | Yes |
Popular Name: (2S)-3-[(3-bromo-4-methoxy-phenyl)methyl-methyl-amino]-2-methyl-propanenitrile (2S)-3-[(3-bromo-4-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) | 3.07 | 6.09 | -7.92 | 0 | 3 | 0 | 36 | 297.196 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.07 | 8.13 | -53.38 | 1 | 3 | 1 | 37 | 298.204 | 5 | ↓ |
