| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 11th, 2008 | 18 | No |
Popular Name: (2E)-1-(4-aminophenyl)-3-(2-methylphenyl)prop-2-en-1-one (2E)-1-(4-aminophenyl)-3-(2-meth…
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CAS Numbers: , 899015-90-8 , [899015-90-8]
(2E)-1-(4-Aminophenyl)-3-(2-methylphenyl)-prop-2-en-1-one
| 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) | 3.11 | 7.65 | -8.83 | 2 | 2 | 0 | 43 | 237.302 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.