In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2005 | 21 | No |
Popular Name: 3-(1,3-benzodioxol-5-yl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid 3-(1,3-benzodioxol-5-yl)-3-[(2,2…
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CAS Number: 174502-41-1
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) | 0.43 | 0.4 | -51.71 | 1 | 6 | -1 | 87 | 304.2 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 150 - 153 | KeyOrganics |