In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2008 | 18 | 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) | 3.14 | 5.13 | -8.94 | 2 | 4 | 0 | 54 | 282.13 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.14 | 5.59 | -36.41 | 3 | 4 | 1 | 55 | 283.138 | 2 | ↓ |