| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 19 | Yes |
Popular Name: 1-(4-carboxyphenyl)-3-n-butyl piperazine 1-(4-carboxyphenyl)-3-n-butyl pi…
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CAS Number: 1131622-30-4
| 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) | 3.53 | 8.05 | -83.89 | 2 | 4 | 0 | 60 | 262.353 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.53 | 6.81 | -51.07 | 1 | 4 | -1 | 55 | 261.345 | 5 | ↓ |
