In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 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) | 2.69 | 5.68 | -41.96 | 2 | 2 | 1 | 20 | 211.716 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.69 | 4.44 | -2.8 | 1 | 2 | 0 | 15 | 210.708 | 1 | ↓ |