In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 26th, 2007 | 35 | 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) | 3.33 | 9.57 | -60.5 | 0 | 8 | -1 | 105 | 484.513 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.33 | 8.81 | -18.28 | 1 | 8 | 0 | 102 | 485.521 | 4 | ↓ |