| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 28th, 2006 | 16 | Yes |
Popular Name: 4-[(2-Chlorobenzyl)amino]-4-oxobutanoic acid 4-[(2-Chlorobenzyl)amino]-4-oxob…
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CAS Numbers: , 904785-49-5
4-[(2-chlorobenzyl)amino]-4-oxobutanoicacid
butanoic acid, 4-[[(2-chlorophenyl)methyl]amino]-4-oxo-
| 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) | 1.23 | 4.52 | -48.51 | 1 | 4 | -1 | 69 | 240.666 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
