In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2010 | 29 | Yes |
Popular Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-3-pentyl-phthalazine-1-carboxamide N-[5-(1-ethylpropyl)-1,3,4-thiad…
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) | 4.50 | 10.28 | -12.94 | 1 | 7 | 0 | 90 | 413.547 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.57 | 9.18 | -49.79 | 0 | 7 | -1 | 96 | 412.539 | 9 | ↓ |