In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 13 | 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) | 0.79 | 2.45 | -9.47 | 1 | 4 | 0 | 49 | 181.239 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.79 | 2.54 | -26.07 | 2 | 4 | 1 | 50 | 182.247 | 4 | ↓ |