In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 18 | No |
Popular Name: (4R)-N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]thiazolidine-4-carboxamide (4R)-N-[1-(2-amino-2-oxo-ethyl)-…
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) | -1.28 | 0.17 | -94.9 | 6 | 6 | 2 | 93 | 274.39 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.28 | -3.25 | -16.14 | 4 | 6 | 0 | 87 | 272.374 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.28 | -1.05 | -49.08 | 5 | 6 | 1 | 89 | 273.382 | 4 | ↓ |