In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 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) | 3.24 | 4.71 | -48.24 | 3 | 3 | 1 | 46 | 289.193 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 5.47 | -63.1 | 2 | 3 | 0 | 49 | 288.185 | 6 | ↓ |