In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2008 | 15 | Yes |
Popular Name: 2-Azepan-1-yl-2-furan-2-yl-ethylamine 2-Azepan-1-yl-2-furan-2-yl-ethyl…
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CAS Numbers: 889939-35-9 , N/A
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) | 1.40 | 3.48 | -44.92 | 3 | 3 | 1 | 44 | 209.313 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 4.61 | -28.23 | 3 | 3 | 1 | 44 | 209.313 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |