In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 38 | 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) | 3.74 | 9.21 | -61.66 | 0 | 8 | -1 | 91 | 519.618 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.74 | 11.47 | -80.04 | 1 | 8 | 0 | 93 | 520.626 | 8 | ↓ |