In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 23 | No |
Popular Name: N-[2-(benzylsulfonylamino)ethyl]-2-thioxo-1H-pyridine-3-carboxamide N-[2-(benzylsulfonylamino)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) | 1.33 | 2.35 | -69.31 | 2 | 6 | -1 | 88 | 350.445 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.33 | 1.96 | -112.86 | 1 | 6 | -2 | 90 | 349.437 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.60 | 2.81 | -49.53 | 3 | 6 | 0 | 91 | 351.453 | 7 | ↓ |