In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 14 | 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) | 2.08 | 1.72 | -39.71 | 0 | 3 | -1 | 39 | 209.225 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.36 | 2.51 | -14.98 | 1 | 3 | 0 | 42 | 210.233 | 2 | ↓ |