In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2004 | 31 | 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) | 5.86 | 8.88 | -19 | 2 | 6 | 0 | 84 | 471.991 | 6 | ↓ |
Hi High (pH 8-9.5) | 6.32 | 7.64 | -49.55 | 1 | 6 | -1 | 87 | 470.983 | 6 | ↓ |