| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 21 | No |
Popular Name: 4-[(1R)-2-[[(3R)-1,1-dioxothiolan-3-yl]-methyl-amino]-1-hydroxy-ethyl]benzenecarbothioamide 4-[(1R)-2-[[(3R)-1,1-dioxothiola…
| 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) | 0.48 | 2.2 | -73.99 | 4 | 5 | 1 | 85 | 329.467 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.48 | -0.65 | -24.68 | 3 | 5 | 0 | 84 | 328.459 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
