In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2009 | 16 | 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) | 0.51 | 1.95 | -46.51 | 4 | 4 | 1 | 66 | 226.296 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.51 | 2.18 | -26.22 | 3 | 4 | 0 | 69 | 225.288 | 5 | ↓ |