In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | No |
Popular Name: 3-[isobutyl-(2-morpholino-2-oxo-ethyl)amino]propanethioamide 3-[isobutyl-(2-morpholino-2-oxo-…
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) | -0.15 | 4.56 | -46.93 | 3 | 5 | 1 | 60 | 288.437 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.15 | 2.83 | -11.42 | 2 | 5 | 0 | 59 | 287.429 | 7 | ↓ |