In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2009 | 11 | 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) | -2.87 | -0.2 | -41.19 | 4 | 4 | 0 | 88 | 179.241 | 6 | ↓ |
Hi High (pH 8-9.5) | -2.87 | -0.48 | -42.17 | 3 | 4 | -1 | 86 | 178.233 | 6 | ↓ |