In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 21 | Yes |
Popular Name: (2S,6R)-2,6-dimethyl-1-tetralin-6-ylsulfonyl-piperazine (2S,6R)-2,6-dimethyl-1-tetralin-…
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) | 2.39 | 5.93 | -49.13 | 2 | 4 | 1 | 54 | 309.455 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.39 | 4.57 | -7.39 | 1 | 4 | 0 | 49 | 308.447 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.