In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2010 | 29 | Yes |
Popular Name: 2-[4-[2-oxo-2-(4-pyrazin-2-ylpiperazin-1-yl)ethyl]piperazin-1-yl]pyridine-4-carbonitrile 2-[4-[2-oxo-2-(4-pyrazin-2-ylpip…
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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) | 0.10 | 6.45 | -15.45 | 0 | 9 | 0 | 92 | 392.467 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.10 | 8.62 | -54.87 | 1 | 9 | 1 | 94 | 393.475 | 4 | ↓ |