| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2010 | 19 | Yes |
Popular Name: 3-chloro-5-(4-methylsulfonyl-1,4-diazepan-1-yl)isothiazole-4-carbonitrile 3-chloro-5-(4-methylsulfonyl-1,4…
| 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) | 1.31 | 2.5 | -17.44 | 0 | 6 | 0 | 77 | 320.827 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
