In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2008 | 21 | No |
None
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) | 0.10 | 3.22 | -62.36 | 8 | 5 | 1 | 121 | 281.339 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.10 | 3.59 | -56.51 | 7 | 5 | 0 | 119 | 280.331 | 2 | ↓ |