| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 15 | No |
Popular Name: (3S)-N-(1,1-dioxothian-4-yl)-1-methyl-pyrrolidin-3-amine (3S)-N-(1,1-dioxothian-4-yl)-1-m…
| 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) | 0.04 | 1.05 | -47.02 | 2 | 4 | 1 | 51 | 233.357 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.04 | -1.46 | -10.88 | 1 | 4 | 0 | 49 | 232.349 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.04 | 2.18 | -132.27 | 3 | 4 | 2 | 55 | 234.365 | 2 | ↓ |
