In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2009 | 13 | 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) | 1.20 | 0.83 | -45.81 | 4 | 3 | 1 | 60 | 183.275 | 0 | ↓ |
Hi High (pH 8-9.5) | 1.20 | 0.65 | -4.77 | 3 | 3 | 0 | 59 | 182.267 | 0 | ↓ |
Hi High (pH 8-9.5) | 1.20 | 0.64 | -4.56 | 3 | 3 | 0 | 59 | 182.267 | 0 | ↓ |