| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 17 | No |
Popular Name: (3S)-1-[(3S)-3-(aminomethyl)-1,1-dioxo-thiolan-3-yl]-N,N-dimethyl-pyrrolidin-3-amine (3S)-1-[(3S)-3-(aminomethyl)-1,1…
| 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) | -1.11 | -0.46 | -111.17 | 4 | 5 | 2 | 69 | 263.407 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.11 | -3.25 | -10.64 | 2 | 5 | 0 | 67 | 261.391 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.11 | -2.84 | -61.42 | 3 | 5 | 1 | 68 | 262.399 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
