In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2009 | 34 | 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) | 5.15 | 14.16 | -67.36 | 1 | 6 | 0 | 74 | 485.024 | 11 | ↓ |
Hi High (pH 8-9.5) | 5.15 | 11.94 | -54.88 | 0 | 6 | -1 | 73 | 484.016 | 11 | ↓ |