In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 12 | 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) | 2.24 | 3.3 | -4.37 | 1 | 2 | 0 | 36 | 166.268 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.24 | 4.58 | -47.52 | 2 | 2 | 1 | 40 | 167.276 | 2 | ↓ |