In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | Yes |
Popular Name: (2R)-2-amino-1-[4-(hydroxymethyl)-1-piperidyl]-3-phenyl-propan-1-one (2R)-2-amino-1-[4-(hydroxymethyl…
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) | 0.47 | 2.7 | -44.05 | 4 | 4 | 1 | 68 | 263.361 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.47 | 2.41 | -8.93 | 3 | 4 | 0 | 67 | 262.353 | 4 | ↓ |