| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 3rd, 2009 | 11 | Yes |
Popular Name: 4-Methylpiperazine-2-carboxylic acid methyl ester 4-Methylpiperazine-2-carboxylic …
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CAS Number: 56903-89-0
2-Piperazinecarboxylic acid, 4-methyl-, methyl ester (9CI)
| 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) | -0.16 | 1.91 | -39.86 | 2 | 4 | 1 | 43 | 159.209 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.16 | 3.17 | -112.91 | 3 | 4 | 2 | 47 | 160.217 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.16 | 0.73 | -36.31 | 2 | 4 | 1 | 46 | 159.209 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.16 | -0.56 | -5.31 | 1 | 4 | 0 | 42 | 158.201 | 2 | ↓ |
