In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 24th, 2006 | 20 | No |
None
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) | 4.18 | 6.73 | -10 | 2 | 4 | 0 | 57 | 330.185 | 2 | ↓ |
Hi High (pH 8-9.5) | 4.64 | 4.68 | -48.45 | 1 | 4 | -1 | 60 | 329.177 | 2 | ↓ |