| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 22 | No |
Popular Name: (E)-3-(3-chloro-4,5-dimethoxy-phenyl)-1-(4-methylpiperazin-1-yl)prop-2-en-1-one (E)-3-(3-chloro-4,5-dimethoxy-ph…
| 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) | 2.36 | 5.3 | -9.91 | 0 | 5 | 0 | 42 | 324.808 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.36 | 7.64 | -48.11 | 1 | 5 | 1 | 43 | 325.816 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
