In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2010 | 28 | 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) | -3.86 | -4.07 | -160.14 | 13 | 11 | 2 | 224 | 404.512 | 16 | ↓ |
Mid Mid (pH 6-8) | -3.86 | -4.41 | -119.87 | 12 | 11 | 1 | 223 | 403.504 | 16 | ↓ |