In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 16 | Yes |
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) | 1.72 | 3.67 | -56.64 | 2 | 5 | -1 | 81 | 229.3 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.72 | 2.55 | -18.49 | 3 | 5 | 0 | 78 | 230.308 | 8 | ↓ |