In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 17th, 2011 | 25 | Yes |
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) | 1.49 | 8.08 | -18.11 | 1 | 6 | 0 | 66 | 344.459 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.49 | 8.54 | -38.52 | 2 | 6 | 1 | 67 | 345.467 | 6 | ↓ |