| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 16th, 2010 | 18 | Yes |
Popular Name: Ethyl 3-amino-4-{[2-(dimethylamino)ethyl]-amino}benzoate Ethyl 3-amino-4-{[2-(dimethylami…
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CAS Numbers: 1220035-46-0 , N/A , [1220035-46-0]
Ethyl 3-amino-4-((2-(dimethylamino)ethyl)amino)benzoate
ethyl3-amino-4-{[2-(dimethylamino)ethyl]-amino}benzoate
| 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) | 1.78 | 5.13 | -46.93 | 4 | 5 | 1 | 69 | 252.338 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.78 | 2.66 | -6.98 | 3 | 5 | 0 | 68 | 251.33 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
