In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2005 | 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) | 3.09 | 12.3 | -23.32 | 0 | 10 | 0 | 121 | 483.484 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.83 | 14.12 | -27.73 | 1 | 10 | 1 | 120 | 484.492 | 7 | ↓ |