In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 14 | No |
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) | 1.77 | 5.23 | -12.32 | 2 | 3 | 0 | 42 | 209.318 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.77 | 5.62 | -40.75 | 3 | 3 | 1 | 43 | 210.326 | 4 | ↓ |