In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 17 | 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) | 1.37 | 1.27 | -37.21 | 5 | 5 | 1 | 91 | 244.359 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.37 | 0.94 | -10.15 | 4 | 5 | 0 | 89 | 243.351 | 8 | ↓ |