In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2009 | 35 | 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) | 0.66 | 4.39 | -21.52 | 1 | 9 | 0 | 91 | 484.597 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.66 | 6.66 | -65.24 | 2 | 9 | 1 | 93 | 485.605 | 7 | ↓ |