| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 15 | No |
Popular Name: (2S)-2-methyl-3-[methyl-[(2-methyl-3-furyl)methyl]amino]propanethioamide (2S)-2-methyl-3-[methyl-[(2-meth…
| 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) | 0.57 | 5.58 | -41.03 | 3 | 3 | 1 | 44 | 227.353 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.57 | 3.51 | -9.63 | 2 | 3 | 0 | 42 | 226.345 | 5 | ↓ |
