In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 21 | Yes |
Popular Name: (6S)-9-[(2S,6R)-2,6-dimethyl-1-piperidyl]-7-oxo-8,10-diazaspiro[4.5]dec-8-ene-6-carbonitrile (6S)-9-[(2S,6R)-2,6-dimethyl-1-p…
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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) | 2.41 | 4.74 | -12.45 | 1 | 5 | 0 | 68 | 288.395 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.41 | 7.6 | -36.38 | 0 | 5 | -1 | 71 | 287.387 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 8.35 | -30.24 | 2 | 5 | 1 | 70 | 289.403 | 1 | ↓ |