In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 16 | Yes |
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) | -0.12 | 3.07 | -89.51 | 4 | 4 | 2 | 51 | 230.352 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.12 | 0.65 | -37.54 | 3 | 4 | 1 | 49 | 229.344 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.