In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 12th, 2007 | 31 | 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) | -2.09 | 5.57 | -55.16 | 3 | 12 | -1 | 176 | 466.477 | 6 | ↓ |
Lo Low (pH 4.5-6) | -2.09 | 5.66 | -60.02 | 4 | 12 | 0 | 178 | 467.485 | 6 | ↓ |