In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 35 | 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) | 5.01 | 14.05 | -46.1 | 1 | 7 | 1 | 64 | 470.549 | 7 | ↓ |
Hi High (pH 8-9.5) | 5.01 | 11.61 | -10.33 | 0 | 7 | 0 | 62 | 469.541 | 7 | ↓ |