In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 25 | 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) | 2.05 | 5.97 | -51.38 | 3 | 6 | 1 | 80 | 366.507 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.50 | 3.44 | -42.86 | 2 | 6 | 0 | 83 | 365.499 | 8 | ↓ |