In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 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) | 2.14 | 8.66 | -44 | 1 | 2 | 1 | 22 | 218.32 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.14 | 6.4 | -5.25 | 0 | 2 | 0 | 20 | 217.312 | 2 | ↓ |