In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2004 | 11 | No |
Popular Name: ethane-1,1,2-tricarboxylate ethane-1,1,2-tricarboxylate
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) | -1.31 | 4.34 | -209.71 | 0 | 6 | -3 | 120 | 159.073 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.31 | 2.79 | -117.38 | 1 | 6 | -2 | 118 | 160.081 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.31 | 2.33 | -114.11 | 1 | 6 | -2 | 118 | 160.081 | 4 | ↓ |
Lo Low (pH 4.5-6) | -1.31 | 0.6 | -45.84 | 2 | 6 | -1 | 115 | 161.089 | 4 | ↓ |