In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 17th, 2005 | 21 | 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) | 3.45 | -0.82 | -14.65 | 1 | 4 | 0 | 46 | 287.407 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.04 | -0.66 | -34.72 | 2 | 4 | 1 | 48 | 288.415 | 7 | ↓ |