In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 18 | Yes |
Popular Name: 1-[4-hydroxy-4-[(2-methoxyethylamino)methyl]-1-piperidyl]butan-1-one 1-[4-hydroxy-4-[(2-methoxyethyla…
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) | 0.35 | 2.25 | -53.24 | 3 | 5 | 1 | 66 | 259.37 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.35 | 1.04 | -10.48 | 2 | 5 | 0 | 62 | 258.362 | 7 | ↓ |