In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 16 | 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) | 1.70 | 3.57 | -42.08 | 4 | 3 | 1 | 60 | 225.287 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.70 | 2.52 | -8.56 | 3 | 3 | 0 | 55 | 224.279 | 5 | ↓ |