| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2008 | 19 | Yes |
Popular Name: N'-[1-(1-Benzofuran-2-yl)ethyl]-N,N-diethylethane-1,2-diamine N'-[1-(1-Benzofuran-2-yl)ethyl]-…
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CAS Number: 1019468-74-6
| 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) | 3.40 | 6.95 | -39.75 | 2 | 3 | 1 | 33 | 261.389 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.40 | 5.58 | -4.59 | 1 | 3 | 0 | 28 | 260.381 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.40 | 9.17 | -115.56 | 3 | 3 | 2 | 34 | 262.397 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.40 | 7.88 | -36.01 | 2 | 3 | 1 | 30 | 261.389 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
