In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 17 | 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) | 1.48 | 2.16 | -52.17 | 5 | 5 | 1 | 82 | 235.311 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.48 | 1.78 | -16.98 | 4 | 5 | 0 | 80 | 234.303 | 4 | ↓ |