In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 13th, 2006 | 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) | 8.98 | 1.54 | -10.42 | 1 | 1 | 0 | 28 | 448.569 | 2 | ↓ |
Mid Mid (pH 6-8) | 8.98 | 1.74 | -31.57 | 2 | 2 | 1 | 29 | 449.577 | 5 | ↓ |