In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 2nd, 2012 | 28 | 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) | -4.59 | -3.49 | -356.54 | 2 | 16 | -4 | 255 | 464.109 | 8 | ↓ |
Mid Mid (pH 6-8) | -4.59 | -4.65 | -220.62 | 3 | 16 | -3 | 253 | 465.117 | 8 | ↓ |