In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 27th, 2006 | 21 | 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) | 3.64 | 9.7 | -9.52 | 1 | 5 | 0 | 56 | 287.411 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.64 | 10.03 | -26.35 | 2 | 5 | 1 | 57 | 288.419 | 4 | ↓ |