| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 20 | Yes |
Popular Name: (3,4-Dimethoxy-benzyl)-(2-morpholin-4-yl-ethyl)-amine (3,4-Dimethoxy-benzyl)-(2-morpho…
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CAS Number: 626209-51-6
| 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) | 1.02 | 1.57 | -7.65 | 1 | 5 | 0 | 43 | 280.368 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.02 | 2.98 | -51.58 | 2 | 5 | 1 | 48 | 281.376 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.02 | 3.89 | -43.14 | 2 | 5 | 1 | 44 | 281.376 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.