In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 31 | 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) | 5.88 | 13.29 | -70.47 | 0 | 5 | -1 | 84 | 423.529 | 8 | ↓ |
Lo Low (pH 4.5-6) | 5.88 | 12.17 | -18.07 | 1 | 5 | 0 | 81 | 424.537 | 8 | ↓ |