In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 27th, 2007 | 37 | 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) | 3.31 | 10.01 | -62.43 | 0 | 8 | -1 | 97 | 500.527 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.75 | 9.15 | -18.5 | 1 | 8 | 0 | 95 | 501.535 | 7 | ↓ |