| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2010 | 20 | No |
Popular Name: (E)-3-[5-(1,4-thiazepane-4-carbonyl)-3-pyridyl]prop-2-enoic (E)-3-[5-(1,4-thiazepane-4-carbo…
| 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) | 0.10 | 7 | -46.37 | 0 | 5 | -1 | 73 | 291.352 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
