In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 14 | Yes |
Popular Name: 4-(4-Methyl-1-piperazinyl)-4-oxobutanoic acid 4-(4-Methyl-1-piperazinyl)-4-oxo…
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CAS Number: 72547-44-5
1-piperazinebutanoic acid, 4-methyl-g-oxo-
4-(4-Methyl-piperazin-1-yl)-4-oxo-butyric acid
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) | -0.66 | 2.65 | -45.31 | 0 | 5 | -1 | 64 | 199.23 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.66 | 3.02 | -43.95 | 2 | 5 | 1 | 62 | 201.246 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 97% | Fluorochem |
Warnings | IRRITANT | Matrix Scientific |