In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 32 | 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) | 5.27 | 13.71 | -64.35 | 1 | 5 | 0 | 65 | 475.416 | 8 | ↓ |
Lo Low (pH 4.5-6) | 5.27 | 12.77 | -44.95 | 2 | 5 | 1 | 62 | 476.424 | 8 | ↓ |