In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 21 | Yes |
Popular Name: (2S)-2-[4-bromo-2-(methylaminomethyl)phenoxy]-1-(1-piperidyl)propan-1-one (2S)-2-[4-bromo-2-(methylaminome…
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) | 2.91 | 8.23 | -37.65 | 2 | 4 | 1 | 46 | 356.284 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.91 | 6.79 | -10.25 | 1 | 4 | 0 | 42 | 355.276 | 5 | ↓ |