In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 25 | Yes |
Popular Name: N-butyl-2,5-dimethyl-N-(2-oxo-2-piperazin-1-yl-ethyl)benzenesulfonamide N-butyl-2,5-dimethyl-N-(2-oxo-2-…
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) | 2.16 | 6.67 | -63.59 | 2 | 6 | 1 | 74 | 368.523 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.16 | 5.3 | -20.17 | 1 | 6 | 0 | 70 | 367.515 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.