In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2007 | 25 | No |
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) | 1.15 | -0.27 | -48.33 | 2 | 8 | 1 | 96 | 347.395 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.15 | 0.93 | -119.38 | 3 | 8 | 2 | 98 | 348.403 | 6 | ↓ |