In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 11 | Yes |
Popular Name: 2-Cyclopropylmethyl-2,5-diaza-bicyclo[2.2.1]heptane di-trifluoroacetic acid 2-Cyclopropylmethyl-2,5-diaza-bi…
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CAS Number: 1208075-35-7
(1S,4S)-2-Cyclopropylmethyl-2,5-diaza-bicyclo[2.2.1]heptane di-trifluoroacetic acid
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) | 0.97 | 2.04 | -39.57 | 2 | 2 | 1 | 20 | 153.249 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.97 | 3.15 | -32.21 | 2 | 2 | 1 | 16 | 153.249 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 122-124° | Oakwood Chemical |