In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 36 | 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) | 5.53 | 13.65 | -42.71 | 1 | 9 | 1 | 96 | 497.547 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.53 | 14.31 | -91.16 | 2 | 9 | 2 | 97 | 498.555 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.53 | 12.56 | -23.62 | 0 | 9 | 0 | 95 | 496.539 | 8 | ↓ |