In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2011 | 27 | Yes |
Popular Name: 1-[1-[(1S)-1-(3-chloro-4-fluoro-phenyl)ethyl]piperidine-4-carbonyl]piperidine-4-carboxamide 1-[1-[(1S)-1-(3-chloro-4-fluoro-…
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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) | 2.70 | 8.16 | -54.86 | 3 | 5 | 1 | 68 | 396.914 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.70 | 6.11 | -15.82 | 2 | 5 | 0 | 67 | 395.906 | 4 | ↓ |