In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2009 | 40 | Yes |
None
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) | 0.33 | 9.7 | -272.41 | 13 | 8 | 5 | 119 | 576.04 | 37 | ↓ |
Mid Mid (pH 6-8) | 0.33 | 13.74 | -608.68 | 16 | 8 | 8 | 133 | 579.064 | 37 | ↓ |