In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 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) | 2.75 | 7.05 | -24.1 | 2 | 3 | 1 | 39 | 216.308 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.75 | 6.97 | -9.27 | 1 | 3 | 0 | 38 | 215.3 | 3 | ↓ |