In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 27th, 2006 | 30 | 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) | 1.57 | 5.65 | -67.34 | 1 | 9 | -1 | 136 | 411.39 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.02 | 3.7 | -26.4 | 2 | 9 | 0 | 133 | 412.398 | 8 | ↓ |