In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 15 | 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) | 2.25 | 3.92 | -6.08 | 0 | 3 | 0 | 36 | 208.305 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.25 | 5.6 | -35.2 | 1 | 3 | 1 | 37 | 209.313 | 1 | ↓ |