In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 16 | 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) | 2.98 | 9.52 | -15.3 | 0 | 2 | 0 | 34 | 218.296 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.73 | 9.45 | -46.64 | 0 | 2 | -1 | 40 | 217.288 | 3 | ↓ |