In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 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) | 4.54 | 10.98 | -47.51 | 0 | 3 | -1 | 31 | 300.794 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.81 | 10.93 | -10.82 | 1 | 3 | 0 | 34 | 301.802 | 3 | ↓ |