In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 15 | 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) | -2.99 | 3.33 | -45.04 | 3 | 5 | 0 | 80 | 216.281 | 5 | ↓ |
Hi High (pH 8-9.5) | -2.99 | 1.34 | -43.3 | 2 | 5 | -1 | 79 | 215.273 | 5 | ↓ |
Mid Mid (pH 6-8) | -2.99 | 1.76 | -32.87 | 3 | 5 | 0 | 80 | 216.281 | 5 | ↓ |
Mid Mid (pH 6-8) | -2.99 | 3.64 | -81.91 | 4 | 5 | 1 | 81 | 217.289 | 5 | ↓ |