| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 21 | No |
Popular Name: (2S)-N-(3-chlorophenyl)-2-(1,1-dioxo-1,4-thiazepan-4-yl)propanamide (2S)-N-(3-chlorophenyl)-2-(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) | 1.66 | 4.44 | -59.89 | 2 | 5 | 1 | 68 | 331.845 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.66 | 2.4 | -17.9 | 1 | 5 | 0 | 66 | 330.837 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
