| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 17 | No |
Popular Name: (2R)-1-[[(3R)-1,1-dioxothiolan-3-yl]-methyl-amino]-3-(propylamino)propan-2-ol (2R)-1-[[(3R)-1,1-dioxothiolan-3…
| 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) | -0.47 | 0.72 | -125.83 | 4 | 5 | 2 | 75 | 266.407 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.47 | -3.53 | -12.73 | 2 | 5 | 0 | 70 | 264.391 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.47 | -2.12 | -52.68 | 3 | 5 | 1 | 74 | 265.399 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.47 | 1.26 | -55.96 | 3 | 5 | 1 | 78 | 265.399 | 7 | ↓ |
