In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 34 | 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) | 4.38 | 10.74 | -54.86 | 0 | 7 | -1 | 88 | 466.554 | 12 | ↓ |
Lo Low (pH 4.5-6) | 4.38 | 9.45 | -18.55 | 1 | 7 | 0 | 85 | 467.562 | 12 | ↓ |