In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 29th, 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) | 2.55 | 5.73 | -12.18 | 1 | 3 | 0 | 38 | 224.263 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.55 | 6.15 | -25.12 | 2 | 3 | 1 | 39 | 225.271 | 2 | ↓ |