In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2011 | 24 | Yes |
Popular Name: 4-[2-(4-chlorophenyl)sulfanylethyl]-N,N-diethyl-piperazine-1-sulfonamide 4-[2-(4-chlorophenyl)sulfanyleth…
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) | 3.10 | 6.39 | -9.42 | 0 | 5 | 0 | 44 | 391.99 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.10 | 8.59 | -52.83 | 1 | 5 | 1 | 45 | 392.998 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.