In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 11th, 2006 | 28 | Yes |
Popular Name: 2-(methyl-oxo-BLAHyl)sulfanyl-N-(p-tolyl)propanamide 2-(methyl-oxo-BLAHyl)sulfanyl-N-…
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) | 5.49 | 9.76 | -15.73 | 2 | 5 | 0 | 75 | 413.568 | 4 | ↓ |
Hi High (pH 8-9.5) | 5.94 | 8.39 | -48.5 | 1 | 5 | -1 | 78 | 412.56 | 4 | ↓ |