In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 35 | Yes |
Popular Name: N-isopropyl-2-methoxy-5-[[4-(o-tolylsulfamoyl)phenyl]sulfamoyl]benzamide N-isopropyl-2-methoxy-5-[[4-(o-t…
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) | 4.27 | 5.5 | -20.69 | 3 | 9 | 0 | 131 | 517.629 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.27 | 5.59 | -50.83 | 2 | 9 | -1 | 133 | 516.621 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.27 | 5.59 | -43.93 | 2 | 9 | -1 | 133 | 516.621 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.27 | 5.68 | -95.73 | 1 | 9 | -2 | 135 | 515.613 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.