In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 18 | Yes |
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) | 1.91 | 7.89 | -57.08 | 0 | 5 | -1 | 67 | 247.274 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 8.37 | -62.98 | 1 | 5 | 0 | 68 | 248.282 | 6 | ↓ |