In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2010 | 25 | No |
Popular Name: (3S)-1-phenyl-3-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]pyrrolidine-2,5-dione (3S)-1-phenyl-3-[[5-(4-pyridyl)-…
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) | 1.26 | 3.7 | -17.36 | 0 | 7 | 0 | 89 | 352.375 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.26 | 4.19 | -50.87 | 1 | 7 | 1 | 90 | 353.383 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.26 | 4.18 | -50.93 | 1 | 7 | 1 | 90 | 353.383 | 4 | ↓ |