| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 15 | Yes |
Popular Name: 4-[cyclohexyl(methyl)amino]-4-oxobutanoic acid 4-[cyclohexyl(methyl)amino]-4-ox…
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CAS Numbers: , 714278-92-9 , [714278-92-9]
4-(Cyclohexyl(methyl)amino)-4-oxobutanoic acid
4-[cyclohexyl(methyl)amino]-4-oxobutanoicacid
butanoic acid, 4-(cyclohexylmethylamino)-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) | 1.36 | 5.63 | -48.24 | 0 | 4 | -1 | 60 | 212.269 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.36 | 4.51 | -9.72 | 1 | 4 | 0 | 58 | 213.277 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
