In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 3rd, 2009 | 26 | 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) | 0.83 | 3.88 | -43.72 | 5 | 7 | 1 | 105 | 353.402 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.83 | 3.5 | -13.29 | 4 | 7 | 0 | 103 | 352.394 | 2 | ↓ |