| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2004 | 21 | Yes |
Popular Name: (3S)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-keto-isochroman-3-carboxamide (3S)-N-(5-ethyl-1,3,4-thiadiazol…
| 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) | 1.56 | 7.12 | -26.09 | 1 | 6 | 0 | 81 | 303.343 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.74 | 4.79 | -52.02 | 0 | 6 | -1 | 88 | 302.335 | 3 | ↓ |
