In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2006 | 27 | 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) | 2.77 | 7.47 | -63.32 | 0 | 6 | -1 | 83 | 388.827 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.77 | 6.65 | -16.94 | 1 | 6 | 0 | 80 | 389.835 | 7 | ↓ |