| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2008 | 22 | Yes |
Popular Name: 3-(azepan-1-yl)-5-(3-chlorophenyl)-4-methyl-isothiazole 3-(azepan-1-yl)-5-(3-chloropheny…
| 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) | 3.96 | 7.16 | -17.59 | 0 | 4 | 0 | 50 | 338.86 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
