In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 17 | No |
Popular Name: N-(2-cyanoethyl)-2-[[(3S)-1,1-dioxothiolan-3-yl]methylamino]acetamide N-(2-cyanoethyl)-2-[[(3S)-1,1-di…
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) | -1.28 | 0.01 | -76.81 | 3 | 6 | 1 | 104 | 260.339 | 6 | ↓ |
Hi High (pH 8-9.5) | -1.28 | -1.35 | -26.56 | 2 | 6 | 0 | 99 | 259.331 | 6 | ↓ |