| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 17 | No |
Popular Name: (3S)-3-(1,4-diazepan-1-yl)-1,1-dioxo-thiolane-3-carboxamide (3S)-3-(1,4-diazepan-1-yl)-1,1-d…
| 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) | -1.77 | -3.72 | -57.53 | 4 | 6 | 1 | 97 | 262.355 | 2 | ↓ |
| Hi High (pH 8-9.5) | -1.77 | -4.99 | -11.78 | 3 | 6 | 0 | 93 | 261.347 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
