In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 18th, 2006 | 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) | 3.74 | 0.26 | -13.84 | 1 | 6 | 0 | 79 | 409.482 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.16 | 0.07 | -20.46 | 0 | 6 | 0 | 76 | 409.482 | 6 | ↓ |