In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 15th, 2010 | 30 | Yes |
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) | 5.05 | 8.83 | -11.4 | 1 | 6 | 0 | 80 | 492.753 | 4 | ↓ |
Hi High (pH 8-9.5) | 5.05 | 9.75 | -49.01 | 0 | 6 | -1 | 83 | 491.745 | 4 | ↓ |