In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 24th, 2008 | 16 | No |
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) | 2.95 | 5.2 | -10.94 | 3 | 3 | 0 | 55 | 249.726 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.95 | 5.44 | -32.03 | 4 | 3 | 1 | 56 | 250.734 | 1 | ↓ |