In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2005 | 14 | 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) | -2.79 | -7.85 | -30.53 | 6 | 6 | 1 | 106 | 208.234 | 3 | ↓ |
Hi High (pH 8-9.5) | -2.79 | -7.32 | -31.61 | 5 | 6 | 0 | 108 | 207.226 | 3 | ↓ |