In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 10th, 2006 | 35 | 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) | 6.17 | 1.24 | -13.09 | 0 | 6 | 0 | 74 | 496.003 | 8 | ↓ |
Mid Mid (pH 6-8) | 6.17 | 1.06 | -15.74 | 0 | 6 | 0 | 74 | 496.003 | 8 | ↓ |
Mid Mid (pH 6-8) | 6.35 | 0.02 | -13.89 | 0 | 6 | 0 | 74 | 496.003 | 8 | ↓ |