In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 16 | No |
Popular Name: 3-[methyl-[(1R)-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl]amino]propanethioamide 3-[methyl-[(1R)-1-methyl-2-oxo-2…
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) | -0.39 | 4.56 | -40.61 | 3 | 4 | 1 | 51 | 244.384 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.39 | 2.34 | -14.35 | 2 | 4 | 0 | 50 | 243.376 | 5 | ↓ |