In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 8th, 2011 | 26 | 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) | 5.37 | 7.77 | -41.69 | 4 | 4 | 1 | 60 | 371.63 | 17 | ↓ |
Mid Mid (pH 6-8) | 5.37 | 8.83 | -87.08 | 5 | 4 | 2 | 62 | 372.638 | 17 | ↓ |