In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 17 | Yes |
Popular Name: (1S,2S,4R)-2-[[(3S)-3-ethylmorpholin-4-yl]methyl]-4-methyl-cyclohexanol (1S,2S,4R)-2-[[(3S)-3-ethylmorph…
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) | 2.20 | 2.98 | -2.71 | 1 | 3 | 0 | 33 | 241.375 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.20 | 4.89 | -32.99 | 2 | 3 | 1 | 34 | 242.383 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.