In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 24 | Yes |
None
None
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) | 1.42 | 2.49 | -11.06 | 2 | 6 | 0 | 65 | 338.496 | 9 | ↓ |
Lo Low (pH 4.5-6) | 1.42 | 4.67 | -37.98 | 3 | 6 | 1 | 66 | 339.504 | 9 | ↓ |
Lo Low (pH 4.5-6) | 1.42 | 4.72 | -38.25 | 3 | 6 | 1 | 66 | 339.504 | 9 | ↓ |