In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 16 | No |
Popular Name: (2R,6R)-2,6-dimethyl-4-[2-[(3S)-3-piperidyl]ethyl]thiomorpholine (2R,6R)-2,6-dimethyl-4-[2-[(3S)-…
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) | 1.93 | 8.04 | -97.04 | 3 | 2 | 2 | 21 | 244.448 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.93 | 6.35 | -40.32 | 2 | 2 | 1 | 20 | 243.44 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.