In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 18 | Yes |
Popular Name: (3S,5S)-3-(4-methoxy-2,3,5-trimethyl-phenyl)-5-methyl-morpholine (3S,5S)-3-(4-methoxy-2,3,5-trime…
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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) | 3.04 | 5.54 | -39.34 | 2 | 3 | 1 | 35 | 250.362 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.04 | 4.32 | -4.39 | 1 | 3 | 0 | 30 | 249.354 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.