In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 14 | 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) | -0.31 | -2.29 | -54.42 | 4 | 5 | 1 | 87 | 281.155 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.31 | -2.68 | -42.85 | 3 | 5 | 0 | 89 | 280.147 | 4 | ↓ |