In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 22 | Yes |
Popular Name: (3R)-1-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)isochroman-3-carboxamide (3R)-1-oxo-N-(5-propyl-1,3,4-thi…
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) | 2.06 | 7.95 | -28.43 | 1 | 6 | 0 | 81 | 317.37 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.24 | 6.88 | -50.39 | 0 | 6 | -1 | 88 | 316.362 | 4 | ↓ |