In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 12th, 2006 | 35 | 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) | 3.43 | 1.73 | -51.05 | 2 | 8 | 1 | 89 | 483.585 | 12 | ↓ |
Mid Mid (pH 6-8) | 2.85 | 1.56 | -57.02 | 1 | 8 | 1 | 86 | 483.585 | 12 | ↓ |