| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 13 | No |
Popular Name: 2-[(S)-(2-bromophenyl)-hydroxy-methyl]prop-2-enenitrile 2-[(S)-(2-bromophenyl)-hydroxy-m…
| 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) | 2.25 | 4.03 | -8.77 | 1 | 2 | 0 | 44 | 238.084 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.25 | 4.61 | -45.99 | 0 | 2 | -1 | 47 | 237.076 | 2 | ↓ |
