In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 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) | 6.18 | 10.74 | -52.52 | 0 | 5 | -1 | 67 | 409.531 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.73 | 11.85 | -12.14 | 1 | 5 | 0 | 64 | 410.539 | 7 | ↓ |