In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 36 | 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) | 4.92 | 8.15 | -53.68 | 0 | 8 | -1 | 103 | 505.934 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.46 | 10.6 | -14.32 | 1 | 8 | 0 | 100 | 506.942 | 8 | ↓ |