In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2009 | 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) | -1.30 | -10.49 | -27.62 | 8 | 12 | 0 | 207 | 466.395 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.30 | -9.48 | -68.4 | 7 | 12 | -1 | 209 | 465.387 | 4 | ↓ |