In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 27 | No |
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) | 4.15 | 9.39 | -37.39 | 0 | 5 | -1 | 67 | 420.297 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.69 | 10.45 | -10.51 | 1 | 5 | 0 | 64 | 421.305 | 4 | ↓ |