| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 24th, 2008 | 19 | Yes |
Popular Name: 1-{2-amino-2-[3-(trifluoromethyl)phenyl]ethyl}pyrrolidin-2-one 1-{2-amino-2-[3-(trifluoromethyl…
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CAS Number: 953898-98-1
| 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) | 0.05 | 5.79 | -60.93 | 3 | 3 | 1 | 48 | 273.278 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.05 | 5.5 | -10.02 | 2 | 3 | 0 | 46 | 272.27 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 76 - 78 | Enamine Building Blocks |
| MP | 76...78 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
