In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 20 | 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) | 0.89 | 6.74 | -20.15 | 0 | 5 | 0 | 55 | 289.36 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.89 | 7.23 | -48.33 | 1 | 5 | 1 | 56 | 290.368 | 1 | ↓ |