In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 25 | Yes |
Popular Name: 1-[(1S)-1-(3,4-difluorophenyl)ethyl]-3-[3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]propyl]urea 1-[(1S)-1-(3,4-difluorophenyl)et…
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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) | 2.83 | 5.02 | -12.05 | 2 | 5 | 0 | 54 | 355.429 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.83 | 6.95 | -49.34 | 3 | 5 | 1 | 55 | 356.437 | 6 | ↓ |