In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 33 | 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) | 6.27 | 13.28 | -7.45 | 0 | 5 | 0 | 39 | 505.877 | 4 | ↓ |
Mid Mid (pH 6-8) | 6.27 | 15.43 | -40.71 | 1 | 5 | 1 | 40 | 506.885 | 4 | ↓ |