In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 18 | 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) | 1.77 | 8.33 | -46.99 | 1 | 4 | 1 | 33 | 247.297 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.77 | 5.97 | -8.59 | 0 | 4 | 0 | 32 | 246.289 | 1 | ↓ |