In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 22 | 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) | 2.51 | 5.36 | -11.97 | 3 | 5 | 0 | 71 | 344.433 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.75 | 4.27 | -36.64 | 2 | 5 | -1 | 77 | 343.425 | 6 | ↓ |