In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 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) | 2.31 | 5.23 | -4.4 | 1 | 2 | 0 | 21 | 201.269 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.31 | 6.64 | -35.56 | 2 | 2 | 1 | 26 | 202.277 | 6 | ↓ |