In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 15 | Yes |
Popular Name: 3-(2,5-dioxo-3,4,6,6a-tetrahydro-1H-pentalen-3a-yl)propanoic 3-(2,5-dioxo-3,4,6,6a-tetrahydro…
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) | -0.32 | 5.84 | -47.22 | 0 | 4 | -1 | 74 | 209.221 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.32 | 3.87 | -15.73 | 1 | 4 | 0 | 71 | 210.229 | 3 | ↓ |