| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 16th, 2010 | 19 | Yes |
Popular Name: N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide hydrochloride N-[3-(trifluoromethyl)phenyl]pip…
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CAS Number: 1458384-01-4
| 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) | 1.86 | 4.96 | -50.03 | 3 | 4 | 1 | 49 | 274.266 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 3.65 | -7.22 | 2 | 4 | 0 | 44 | 273.258 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
