In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2008 | 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) | 3.13 | 7.08 | -8.01 | 2 | 3 | 0 | 44 | 235.718 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.13 | 7.16 | -32.38 | 3 | 3 | 1 | 45 | 236.726 | 3 | ↓ |