| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 19 | Yes |
Popular Name: (3S)-1,1-dioxo-N-[(1S)-1-(3-thienyl)ethyl]-2,3-dihydrobenzothiophen-3-amine (3S)-1,1-dioxo-N-[(1S)-1-(3-thie…
| 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) | 2.35 | 3.65 | -12.71 | 1 | 3 | 0 | 46 | 293.413 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.35 | 4.61 | -55.65 | 2 | 3 | 1 | 51 | 294.421 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
