In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 16th, 2010 | 19 | 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) | 4.29 | 9.17 | -11.68 | 0 | 2 | 0 | 18 | 258.271 | 1 | ↓ |
Lo Low (pH 4.5-6) | 4.29 | 9.61 | -25.35 | 1 | 2 | 1 | 19 | 259.279 | 1 | ↓ |