In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2006 | 24 | 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) | 0.98 | 6.47 | -58.85 | 1 | 10 | 1 | 116 | 338.344 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.98 | 4.34 | -29.09 | 0 | 10 | 0 | 115 | 337.336 | 8 | ↓ |