| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2011 | 21 | Yes |
Popular Name: (3S)-1-[(3S)-1,1-dioxo-2,3-dihydrobenzothiophen-3-yl]-3-methyl-piperidine-3-carboxylic (3S)-1-[(3S)-1,1-dioxo-2,3-dihyd…
| 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) | 1.31 | 4.29 | -55.73 | 0 | 5 | -1 | 78 | 308.379 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.31 | 6.12 | -61.3 | 1 | 5 | 0 | 79 | 309.387 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
