In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 29 | Yes |
Popular Name: 4-allyl-2-[[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-6-methoxy-phenol 4-allyl-2-[[4-[(3-fluoro-4-metho…
None
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) | 3.50 | 8.37 | -39.03 | 2 | 5 | 1 | 46 | 401.502 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.50 | 8.26 | -46.33 | 2 | 5 | 1 | 46 | 401.502 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.50 | 5.94 | -9.66 | 1 | 5 | 0 | 45 | 400.494 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.