In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 12th, 2011 | 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) | 5.11 | 12.74 | -136.57 | 0 | 4 | -2 | 80 | 282.38 | 12 | ↓ |
Lo Low (pH 4.5-6) | 5.11 | 10.61 | -49.3 | 1 | 4 | -1 | 77 | 283.388 | 12 | ↓ |
Lo Low (pH 4.5-6) | 5.11 | 10.76 | -56.79 | 1 | 4 | -1 | 77 | 283.388 | 12 | ↓ |