In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 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) | 4.67 | 9.59 | -11.18 | 0 | 6 | 0 | 65 | 431.916 | 9 | ↓ |
Lo Low (pH 4.5-6) | 4.67 | 11.86 | -46.48 | 1 | 6 | 1 | 66 | 432.924 | 9 | ↓ |