In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 7th, 2009 | 26 | 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) | 3.59 | 9.47 | -11.07 | 2 | 4 | 0 | 58 | 367.518 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.59 | 10.14 | -76.62 | 3 | 4 | 1 | 62 | 368.526 | 5 | ↓ |