In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 13 | Yes |
None
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) | -1.19 | 3.97 | -39.23 | 3 | 4 | 0 | 71 | 188.271 | 7 | ↓ |
Mid Mid (pH 6-8) | -1.19 | 2.52 | -32.73 | 3 | 4 | 0 | 71 | 188.271 | 7 | ↓ |
Mid Mid (pH 6-8) | -1.19 | 4.37 | -81.2 | 4 | 4 | 1 | 72 | 189.279 | 7 | ↓ |