In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2010 | 38 | No |
Popular Name: 4-(2-carboxyethyl)-4-[di(nonyl)carbamoylamino]heptanedioic 4-(2-carboxyethyl)-4-[di(nonyl)c…
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) | 7.89 | 19.84 | -194.57 | 1 | 9 | -3 | 153 | 539.734 | 26 | ↓ |
Lo Low (pH 4.5-6) | 7.89 | 17.86 | -117.68 | 2 | 9 | -2 | 150 | 540.742 | 26 | ↓ |