In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 30 | 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) | 5.81 | 12.04 | -46.34 | 2 | 6 | 1 | 62 | 409.554 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.81 | 9.82 | -11.33 | 1 | 6 | 0 | 61 | 408.546 | 4 | ↓ |