In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 27 | 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) | 3.81 | 7.85 | -52.79 | 0 | 5 | -1 | 70 | 409.22 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.81 | 7.1 | -16.07 | 1 | 5 | 0 | 67 | 410.228 | 4 | ↓ |