In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2007 | 34 | No |
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) | 4.47 | 11.5 | -47.43 | 2 | 7 | 1 | 81 | 467.586 | 11 | ↓ |
Mid Mid (pH 6-8) | 3.44 | 12.14 | -46.16 | 1 | 7 | 1 | 77 | 467.586 | 12 | ↓ |