In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 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) | 0.66 | 0.14 | -18.23 | 3 | 15 | 0 | 177 | 487.477 | 9 | ↓ |
Mid Mid (pH 6-8) | 0.66 | 2.48 | -54.57 | 4 | 15 | 1 | 178 | 488.485 | 9 | ↓ |