| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 2nd, 2010 | 13 | Yes |
Popular Name: N-(3-Methoxybenzyl)ethane-1,2-diamine N-(3-Methoxybenzyl)ethane-1,2-di…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1048675-29-1 , [1048675-29-1]
None
| 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) | 0.33 | 1.92 | -121.58 | 5 | 3 | 2 | 53 | 182.267 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.33 | 1.55 | -39.07 | 4 | 3 | 1 | 52 | 181.259 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.33 | 0.57 | -44.08 | 4 | 3 | 1 | 49 | 181.259 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
