In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 17 | Yes |
Popular Name: (2S,6R)-2,6-dimethyl-1-(3-pyridylsulfonyl)piperazine (2S,6R)-2,6-dimethyl-1-(3-pyridy…
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) | 0.14 | 1.65 | -50.98 | 2 | 5 | 1 | 67 | 256.351 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.14 | 0.3 | -8.37 | 1 | 5 | 0 | 62 | 255.343 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.