| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 19 | Yes |
Popular Name: N1,N1-diethyl-N2-[2-(4-ethylphenoxy)ethyl]-1,2-ethanediamine N1,N1-diethyl-N2-[2-(4-ethylphen…
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CAS Number: 1040686-01-8
1,2-ethanediamine, N,N-diethyl-N'-[2-(4-ethylphenoxy)ethyl]-
| 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) | 3.13 | 7.5 | -32.96 | 2 | 3 | 1 | 26 | 265.421 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 5.21 | -2.61 | 1 | 3 | 0 | 24 | 264.413 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.13 | 6.61 | -40.34 | 2 | 3 | 1 | 29 | 265.421 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.13 | 8.93 | -113.18 | 3 | 3 | 2 | 30 | 266.429 | 10 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
