| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 19 | No |
Popular Name: (3S)-1-[(3S)-3-(aminomethyl)-1,1-dioxo-thiolan-3-yl]-N,N-diethyl-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) | -0.36 | 0.32 | -121.07 | 4 | 5 | 2 | 69 | 291.461 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.36 | -2.11 | -9.72 | 2 | 5 | 0 | 67 | 289.445 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.36 | -1.8 | -60.94 | 3 | 5 | 1 | 68 | 290.453 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
