In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 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) | 1.68 | 4.98 | -44.72 | 3 | 4 | 1 | 59 | 259.329 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.68 | 5.45 | -101.79 | 4 | 4 | 2 | 60 | 260.337 | 6 | ↓ |