In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 18 | 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) | 1.82 | 8.18 | -73.72 | 1 | 7 | 0 | 100 | 254.242 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.82 | 5.73 | -47.7 | 0 | 7 | -1 | 98 | 253.234 | 6 | ↓ |