In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2004 | 37 | No |
Popular Name: 4-nitro-N-[4-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]phenyl]benzenesulfonamide 4-nitro-N-[4-[2-[4-(1,1,3,3-tetr…
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) | 7.53 | -0.8 | -13.53 | 1 | 8 | 0 | 110 | 526.655 | 12 | ↓ |
Hi High (pH 8-9.5) | 7.53 | -0.22 | -36.78 | 0 | 8 | -1 | 112 | 525.647 | 12 | ↓ |
No pre-computed analogs available. Try a structural similarity search.