In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 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) | -0.56 | -2.01 | -12.8 | 6 | 6 | 0 | 125 | 214.25 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.43 | -1.47 | -42.82 | 7 | 6 | 1 | 124 | 215.258 | 3 | ↓ |