In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 13th, 2007 | 20 | 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) | -0.51 | -2.79 | -11.8 | 2 | 6 | 0 | 83 | 270.292 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.51 | -3.14 | -30.67 | 3 | 6 | 1 | 85 | 271.3 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.51 | -2.67 | -41.62 | 3 | 6 | 1 | 85 | 271.3 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.51 | -3.03 | -74.25 | 4 | 6 | 2 | 86 | 272.308 | 4 | ↓ |