In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 36 | 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) | 5.82 | 10.46 | -36.56 | 3 | 7 | 1 | 77 | 507.01 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.82 | 8.4 | -14.3 | 2 | 7 | 0 | 76 | 506.002 | 7 | ↓ |