In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 2nd, 2010 | 19 | 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) | 1.10 | 4.1 | -9.86 | 2 | 5 | 0 | 71 | 275.333 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.29 | 3.52 | -45.66 | 1 | 5 | -1 | 77 | 274.325 | 4 | ↓ |