| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 24 | Yes |
Popular Name: 1,4-Benzyl-piperazine-2-carboxylic acid methyl ester 1,4-Benzyl-piperazine-2-carboxyl…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 17532-21-7 , 54969-33-4
2-Piperazinecarboxylicacid, 1,4-bis(phenylmethyl)-, methyl ester
| 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) | 2.88 | 10.17 | -33.14 | 1 | 4 | 1 | 34 | 325.432 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.88 | 8.05 | -6.23 | 0 | 4 | 0 | 33 | 324.424 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.88 | 10.37 | -43.96 | 1 | 4 | 1 | 34 | 325.432 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.88 | 12.51 | -121.71 | 2 | 4 | 2 | 35 | 326.44 | 6 | ↓ |
