In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2011 | 30 | 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) | 0.55 | 3.67 | -64.64 | 4 | 10 | -1 | 153 | 483.602 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.55 | 4.15 | -75.82 | 5 | 10 | 0 | 155 | 484.61 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.