In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 31 | 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) | 1.62 | 3.26 | -17.81 | 3 | 12 | 0 | 150 | 445.871 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.62 | 5.59 | -48.36 | 4 | 12 | 1 | 151 | 446.879 | 6 | ↓ |