In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 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) | 4.41 | 12.73 | -12.08 | 3 | 10 | 0 | 141 | 411.397 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.41 | 13.48 | -39.14 | 2 | 10 | -1 | 144 | 410.389 | 7 | ↓ |