In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 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) | 1.83 | 7.73 | -48.06 | 2 | 4 | 1 | 41 | 272.372 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 5.52 | -13.18 | 1 | 4 | 0 | 39 | 271.364 | 3 | ↓ |