In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 33 | 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) | 1.66 | 8.49 | -21.68 | 3 | 8 | 0 | 103 | 451.571 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.66 | 8.98 | -48.97 | 4 | 8 | 1 | 105 | 452.579 | 8 | ↓ |