| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2010 | 19 | No |
Popular Name: [5-(3-hydroxyprop-1-ynyl)-3-pyridyl]-(1,4-thiazepan-4-yl)methanone [5-(3-hydroxyprop-1-ynyl)-3-pyri…
| 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) | -0.13 | 3.97 | -10.33 | 1 | 4 | 0 | 53 | 276.361 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
