In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2010 | 24 | Yes |
Popular Name: (1R,5S)-7-[4-(2-pyridyl)piperazine-1-carbonyl]bicyclo[3.3.1]nonan-9-one (1R,5S)-7-[4-(2-pyridyl)piperazi…
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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) | 1.94 | 9.12 | -41.71 | 1 | 5 | 1 | 55 | 328.436 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.94 | 8.81 | -11.85 | 0 | 5 | 0 | 54 | 327.428 | 2 | ↓ |