In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 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) | 2.86 | 9.19 | -57.55 | 2 | 8 | 1 | 90 | 469.558 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.28 | 9.84 | -68.84 | 1 | 8 | 1 | 87 | 469.558 | 10 | ↓ |