| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2008 | 15 | No |
Popular Name: (2R)-1-[[(3R)-1,1-dioxothiolan-3-yl]-methyl-amino]-3-methylamino-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) | -1.00 | -0.85 | -126.24 | 4 | 5 | 2 | 75 | 238.353 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.00 | -2.42 | -59.37 | 3 | 5 | 1 | 71 | 237.345 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.00 | -3.22 | -48.8 | 3 | 5 | 1 | 74 | 237.345 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.00 | -4.78 | -12.98 | 2 | 5 | 0 | 70 | 236.337 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.00 | -2.91 | -36.82 | 2 | 5 | 0 | 77 | 236.337 | 5 | ↓ |
