In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 16 | No |
Popular Name: [(2R,5S)-5-[[(2S,6R)-2,6-dimethylthiomorpholin-4-yl]methyl]tetrahydrofuran-2-yl]methanamine [(2R,5S)-5-[[(2S,6R)-2,6-dimethy…
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) | 0.62 | 5.04 | -99.74 | 4 | 3 | 2 | 41 | 246.42 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.62 | 2.91 | -40.86 | 3 | 3 | 1 | 40 | 245.412 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.