In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 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) | 3.98 | 10.07 | -13.68 | 1 | 7 | 0 | 84 | 489.597 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.98 | 12.34 | -53.99 | 2 | 7 | 1 | 85 | 490.605 | 8 | ↓ |