In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 13th, 2009 | 39 | 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) | 4.32 | 12.21 | -39.54 | 0 | 8 | -1 | 101 | 529.613 | 13 | ↓ |
Lo Low (pH 4.5-6) | 4.32 | 11.08 | -19.92 | 1 | 8 | 0 | 98 | 530.621 | 13 | ↓ |
Lo Low (pH 4.5-6) | 4.32 | 11.52 | -54.61 | 2 | 8 | 1 | 99 | 531.629 | 13 | ↓ |