In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2009 | 51 | 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) | -4.66 | -3.58 | -59.72 | 12 | 20 | 1 | 311 | 720.809 | 19 | ↓ |
Mid Mid (pH 6-8) | -4.66 | -3.82 | -30.61 | 11 | 20 | 0 | 310 | 719.801 | 19 | ↓ |