In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | 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) | 0.38 | 3.36 | -14.17 | 2 | 5 | 0 | 59 | 313.467 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.38 | 5.54 | -49.31 | 3 | 5 | 1 | 60 | 314.475 | 6 | ↓ |