In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2009 | 21 | Yes |
Popular Name: 4-methyl-5-[(2R)-2-(4-pyridyl)pyrrolidin-1-yl]sulfonyl-3H-thiazol-2-one 4-methyl-5-[(2R)-2-(4-pyridyl)py…
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) | 0.83 | 2.42 | -14.33 | 1 | 6 | 0 | 83 | 325.415 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.29 | 0.29 | -44.29 | 0 | 6 | -1 | 86 | 324.407 | 3 | ↓ |