In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2010 | 19 | 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) | -0.46 | -6.98 | -13.23 | 4 | 9 | 0 | 138 | 268.277 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.46 | -6.73 | -59.82 | 5 | 9 | 1 | 139 | 269.285 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.