In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2010 | 23 | Yes |
Popular Name: (2R)-1-[(2S,6S)-2,6-dimethyl-1-piperidyl]-2-(4-pyrrolidin-1-yl-1-piperidyl)propan-1-one (2R)-1-[(2S,6S)-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 | 10.65 | -98.88 | 2 | 4 | 2 | 29 | 323.525 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.41 | 8.55 | -34.54 | 1 | 4 | 1 | 28 | 322.517 | 3 | ↓ |