In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 13 | 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) | -0.32 | -0.32 | -42.46 | 4 | 4 | 1 | 68 | 189.279 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.32 | 0.22 | -8.59 | 3 | 4 | 0 | 67 | 188.271 | 6 | ↓ |