In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 25th, 2008 | 29 | 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) | 0.44 | 3.76 | -14.82 | 4 | 10 | 0 | 134 | 403.439 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.44 | 4.18 | -42.8 | 5 | 10 | 1 | 136 | 404.447 | 8 | ↓ |