In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 21st, 2009 | 23 | 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) | -3.68 | 5.6 | -37.14 | 2 | 5 | 1 | 77 | 306.345 | 2 | ↓ |
Hi High (pH 8-9.5) | -3.68 | 6.37 | -41.41 | 1 | 5 | 0 | 80 | 305.337 | 2 | ↓ |