| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 18 | Yes |
Popular Name: 3-(2-(aminomethyl)pyrrolidin-1-yl)benzo[d]isothiazole 1,1-dioxide hydrochloride 3-(2-(aminomethyl)pyrrolidin-1-y…
| 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) | -0.52 | 2.01 | -43.58 | 3 | 5 | 1 | 77 | 266.346 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.52 | 1.94 | -18.41 | 2 | 5 | 0 | 76 | 265.338 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
