In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2010 | 15 | 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) | 0.73 | 2.1 | -34.46 | 2 | 4 | 1 | 43 | 220.333 | 11 | ↓ |
Mid Mid (pH 6-8) | 0.73 | 1.14 | -4.25 | 1 | 4 | 0 | 42 | 219.325 | 11 | ↓ |