| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 20 | No |
Popular Name: 2-(4-methyl-3-nitro-anilino)-1-piperazin-1-yl-ethanone 2-(4-methyl-3-nitro-anilino)-1-p…
| 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) | 0.78 | 4.62 | -60.95 | 3 | 7 | 1 | 95 | 279.32 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.78 | 3.33 | -14.65 | 2 | 7 | 0 | 90 | 278.312 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
