In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | No |
Popular Name: (4S)-N-[1-[2-(methylamino)-2-oxo-ethyl]-4-piperidyl]thiazolidine-4-carboxamide (4S)-N-[1-[2-(methylamino)-2-oxo…
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) | -0.41 | 1.63 | -94.34 | 5 | 6 | 2 | 79 | 288.417 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.41 | -1.92 | -11.5 | 3 | 6 | 0 | 73 | 286.401 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.41 | 0.26 | -44.86 | 4 | 6 | 1 | 75 | 287.409 | 4 | ↓ |