In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 17 | No |
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) | 2.55 | 6.42 | -10.67 | 0 | 3 | 0 | 39 | 227.263 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.55 | 6.81 | -40.22 | 1 | 3 | 1 | 40 | 228.271 | 4 | ↓ |