| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 19 | Yes |
Popular Name: N1-[4-(Diethylamino)benzyl]-N3-ethyl-1,3-propanediamine N1-[4-(Diethylamino)benzyl]-N3-e…
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CAS Number: 932251-16-6
1,3-propanediamine, N-[[4-(diethylamino)phenyl]methyl]-N'-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) | 2.43 | 7.06 | -36.66 | 3 | 3 | 1 | 32 | 264.437 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.43 | 8.52 | -25.62 | 5 | 3 | 0 | 38 | 266.453 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.43 | 7.18 | -66.23 | 4 | 3 | 0 | 33 | 265.445 | 10 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
