In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2009 | 19 | 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) | 1.32 | 6.99 | -47.36 | 2 | 4 | 1 | 41 | 258.345 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.32 | 4.77 | -13.34 | 1 | 4 | 0 | 39 | 257.337 | 2 | ↓ |