| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 19 | No |
Popular Name: (4S)-N-[(3R)-1,1-dioxothian-3-yl]isothiochroman-4-amine (4S)-N-[(3R)-1,1-dioxothian-3-yl…
| 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) | 1.78 | 5.08 | -56.63 | 2 | 3 | 1 | 51 | 298.453 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.78 | 4.41 | -11.96 | 1 | 3 | 0 | 46 | 297.445 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
