In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2006 | 32 | 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) | 2.14 | -0.59 | -46.27 | 2 | 8 | 1 | 93 | 441.504 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.56 | -0.77 | -54.35 | 1 | 8 | 1 | 90 | 441.504 | 8 | ↓ |