In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2010 | 37 | 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) | 4.57 | 11.21 | -12.78 | 0 | 7 | 0 | 72 | 496.563 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.57 | 13.46 | -48.31 | 1 | 7 | 1 | 73 | 497.571 | 7 | ↓ |