In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 14 | 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) | -1.66 | 4.04 | -41.09 | 2 | 5 | 0 | 77 | 200.238 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.66 | 2.71 | -51.32 | 1 | 5 | -1 | 72 | 199.23 | 4 | ↓ |