In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2011 | 29 | No |
Popular Name: 2-(4-methyl-2-nitro-phenoxy)-1-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone 2-(4-methyl-2-nitro-phenoxy)-1-[…
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) | 3.25 | 10.16 | -24.66 | 0 | 8 | 0 | 88 | 399.447 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.25 | 12.41 | -65.3 | 1 | 8 | 1 | 89 | 400.455 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.