In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 17 | 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) | 3.82 | 8.29 | -47.32 | 0 | 3 | -1 | 53 | 228.271 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.82 | 8.6 | -41.48 | 1 | 3 | 0 | 54 | 229.279 | 4 | ↓ |