In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 16 | Yes |
Popular Name: (2R)-2-amino-1-[(3R)-3-ethyl-1-piperidyl]-4-methyl-pentan-1-one (2R)-2-amino-1-[(3R)-3-ethyl-1-p…
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) | 1.83 | 4.9 | -41.28 | 3 | 3 | 1 | 48 | 227.372 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.83 | 4.62 | -5.53 | 2 | 3 | 0 | 46 | 226.364 | 4 | ↓ |