In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 20 | 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) | 4.84 | 11.85 | -35.62 | 1 | 2 | 1 | 14 | 343.329 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.84 | 9.78 | -4.15 | 0 | 2 | 0 | 12 | 342.321 | 9 | ↓ |