In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 20 | Yes |
Popular Name: (1S)-1-(3-bromophenyl)-2-[(1-ethyl-4-piperidyl)methylamino]ethanol (1S)-1-(3-bromophenyl)-2-[(1-eth…
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) | 2.52 | 7.35 | -103.35 | 4 | 3 | 2 | 41 | 343.309 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.52 | 6.07 | -34.13 | 3 | 3 | 1 | 37 | 342.301 | 6 | ↓ |