In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 10th, 2011 | 40 | 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) | -4.40 | -5.99 | -250.04 | 18 | 14 | 4 | 270 | 575.8 | 25 | ↓ |
Hi High (pH 8-9.5) | -4.40 | -6.33 | -177.82 | 17 | 14 | 3 | 268 | 574.792 | 25 | ↓ |