| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 22nd, 2011 | 20 | Yes |
Popular Name: N,N-Dimethyl-N'-(2,3,4-trimethoxy-benzyl)-propane-1,3-diamine N,N-Dimethyl-N'-(2,3,4-trimethox…
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CAS Number: 626216-54-4
| 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) | 1.63 | 5.13 | -39.25 | 2 | 5 | 1 | 44 | 283.392 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.63 | 4.04 | -44.16 | 2 | 5 | 1 | 48 | 283.392 | 9 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
