In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2004 | 34 | 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) | 7.12 | 13.49 | -17.4 | 2 | 5 | 0 | 75 | 489.666 | 5 | ↓ |
Hi High (pH 8-9.5) | 7.58 | 12.24 | -48.72 | 1 | 5 | -1 | 78 | 488.658 | 5 | ↓ |