| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 21 | No |
Popular Name: 2-[[(3S)-1,1-dioxothian-3-yl]amino]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxylic 2-[[(3S)-1,1-dioxothian-3-yl]ami…
| 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) | 1.08 | 5.19 | -44.05 | 2 | 6 | 0 | 100 | 310.375 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.08 | 4.89 | -55.63 | 1 | 6 | -1 | 99 | 309.367 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
