In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2011 | 33 | 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) | -1.00 | 5.15 | -54.4 | 6 | 11 | 0 | 173 | 474.543 | 10 | ↓ |
Hi High (pH 8-9.5) | -1.00 | 4.8 | -57.28 | 5 | 11 | -1 | 171 | 473.535 | 10 | ↓ |