| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 17 | No |
Popular Name: (4S)-N-(1-oxothian-4-yl)-4,5,6,7-tetrahydrobenzothiophen-4-amine (4S)-N-(1-oxothian-4-yl)-4,5,6,7…
| 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) | 0.57 | 4.85 | -49.64 | 2 | 2 | 1 | 34 | 270.443 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.57 | 4.3 | -12.87 | 1 | 2 | 0 | 29 | 269.435 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
