In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2010 | 17 | Yes |
Popular Name: (2S)-2-[4-bromo-2-(ethylaminomethyl)phenoxy]propanoic (2S)-2-[4-bromo-2-(ethylaminomet…
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) | 2.27 | 7.35 | -49.52 | 2 | 4 | 0 | 66 | 302.168 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.27 | 5.96 | -45.62 | 1 | 4 | -1 | 61 | 301.16 | 6 | ↓ |