In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 19 | 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) | 1.83 | 3.16 | -38.62 | 2 | 4 | 1 | 38 | 269.409 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.83 | 5.03 | -115.05 | 3 | 4 | 2 | 40 | 270.417 | 3 | ↓ |