| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2004 | 16 | Yes |
Popular Name: 3-(2,5-Dimethoxy-benzylamino)-propan-1-ol 3-(2,5-Dimethoxy-benzylamino)-pr…
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CAS Numbers: 40171-91-3 , [40171-91-3]
| 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) | 1.18 | 1.34 | -38.18 | 3 | 4 | 1 | 55 | 226.296 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.