In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 20 | Yes |
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) | 5.15 | 10.96 | -37.6 | 2 | 1 | 1 | 17 | 286.464 | 4 | ↓ |
Hi High (pH 8-9.5) | 5.15 | 9.76 | -3.12 | 1 | 1 | 0 | 12 | 285.456 | 4 | ↓ |