| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 12th, 2008 | 16 | No |
Popular Name: (3aS,7aR)-2-thiazol-2-yl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione (3aS,7aR)-2-thiazol-2-yl-3a,4,5,…
| 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) | 1.75 | 5.58 | -11.47 | 0 | 4 | 0 | 50 | 236.296 | 1 | ↓ |
| Ref Reference (pH 7) | 2.59 | 1.75 | -9.23 | 2 | 4 | 0 | 58 | 236.296 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.59 | 2.52 | -46.11 | 1 | 4 | -1 | 61 | 235.288 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
