In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2010 | 20 | No |
Popular Name: 2-[[2-[[(3R)-1,1-dioxothiolan-3-yl]amino]-2-oxo-ethyl]-methyl-amino]-N-prop-2-ynyl-acetamide 2-[[2-[[(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) | -0.76 | -0.14 | -61.44 | 3 | 7 | 1 | 97 | 302.376 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.76 | -2.33 | -25.47 | 2 | 7 | 0 | 96 | 301.368 | 6 | ↓ |