In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2011 | 27 | Yes |
Popular Name: N-[2-(2-diethylaminoethyloxy)ethyl]-4-(2-oxo-1-piperidyl)benzenesulfonamide N-[2-(2-diethylaminoethyloxy)eth…
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) | 1.43 | 6.23 | -41.56 | 2 | 7 | 1 | 80 | 398.549 | 11 | ↓ |
Hi High (pH 8-9.5) | 1.43 | 3.74 | -14.22 | 1 | 7 | 0 | 79 | 397.541 | 11 | ↓ |
No pre-computed analogs available. Try a structural similarity search.