In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2011 | 22 | Yes |
Popular Name: (3R)-N-ethyl-1-[2-[(5-methyl-2-thienyl)methylamino]-2-oxo-ethyl]piperidine-3-carboxamide (3R)-N-ethyl-1-[2-[(5-methyl-2-t…
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) | 1.72 | 5.82 | -39.39 | 3 | 5 | 1 | 63 | 324.47 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.72 | 3.66 | -10.52 | 2 | 5 | 0 | 61 | 323.462 | 6 | ↓ |