| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 23 | Yes |
Popular Name: MFCD10687531 MFCD10687531
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CAS Number: 1040686-59-6
benzenemethanamine, N-[[3-(2-ethoxyethoxy)phenyl]methyl]-4-methoxy-
| 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) | 3.25 | 8.02 | -48.31 | 2 | 4 | 1 | 44 | 316.421 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.25 | 6.61 | -7.64 | 1 | 4 | 0 | 40 | 315.413 | 10 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
