| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 16 | No |
Popular Name: (2R,3S)-N1-[(3R)-1,1-dioxothiolan-3-yl]-N1,3-dimethyl-pentane-1,2-diamine (2R,3S)-N1-[(3R)-1,1-dioxothiola…
| 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) | 0.35 | 0.05 | -53.31 | 3 | 4 | 1 | 65 | 249.4 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.35 | 2.06 | -139.81 | 4 | 4 | 2 | 66 | 250.408 | 5 | ↓ |
