In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 35 | 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) | 4.10 | 13.95 | -70.78 | 1 | 8 | -1 | 122 | 477.537 | 11 | ↓ |
Lo Low (pH 4.5-6) | 4.10 | 13.46 | -58.41 | 2 | 8 | 0 | 123 | 478.545 | 11 | ↓ |