| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 18th, 2009 | 17 | No |
Popular Name: (Z)-1,1,1-trifluoro-4-[4-(2-hydroxyethyl)piperazino]-3-buten-2-one (Z)-1,1,1-trifluoro-4-[4-(2-hydr…
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CAS Number: 478040-79-8
| 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) | -0.13 | 1.12 | -10.39 | 1 | 4 | 0 | 44 | 252.236 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.13 | 3.43 | -43.74 | 2 | 4 | 1 | 45 | 253.244 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 40 - 42 | KeyOrganics |
