In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2011 | 21 | Yes |
Popular Name: (2S)-1-(2-bromo-4-chloro-phenoxy)-3-[(2R,5R)-2,5-dimethylmorpholin-4-yl]propan-2-ol (2S)-1-(2-bromo-4-chloro-phenoxy…
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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) | 3.33 | 3.39 | -7.5 | 1 | 4 | 0 | 42 | 378.694 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.33 | 5.59 | -42.82 | 2 | 4 | 1 | 43 | 379.702 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.