In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 15 | 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) | 0.19 | 5.71 | -38.13 | 2 | 4 | 0 | 66 | 209.245 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.19 | 4.38 | -46.87 | 1 | 4 | -1 | 61 | 208.237 | 6 | ↓ |