In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 25 | Yes |
Popular Name: 1-[4-(2-chloro-4-fluoro-benzoyl)piperazin-1-yl]-2-morpholino-ethanone 1-[4-(2-chloro-4-fluoro-benzoyl)…
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) | 0.76 | 4.61 | -12.86 | 0 | 6 | 0 | 53 | 369.824 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.76 | 6.82 | -47.62 | 1 | 6 | 1 | 54 | 370.832 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.