In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2008 | 30 | Yes |
None
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) | 2.53 | 10.25 | -53.91 | 1 | 7 | 1 | 61 | 415.558 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.53 | 7.97 | -13.75 | 0 | 7 | 0 | 60 | 414.55 | 8 | ↓ |