In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2010 | 20 | 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) | -0.73 | 2.44 | -10.83 | 1 | 6 | 0 | 72 | 277.324 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.73 | 2.9 | -42.6 | 2 | 6 | 1 | 73 | 278.332 | 5 | ↓ |