In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2007 | 32 | 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) | 5.22 | 12.31 | -55.35 | 0 | 5 | -1 | 73 | 443.479 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.67 | 11.74 | -18.74 | 1 | 5 | 0 | 71 | 444.487 | 3 | ↓ |