In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 21 | Yes |
Popular Name: 4-[[4-(cyanomethyl)phenyl]sulfamoyl]-1H-pyrrole-2-carboxylic 4-[[4-(cyanomethyl)phenyl]sulfam…
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) | 1.32 | 3.87 | -55 | 2 | 7 | -1 | 126 | 304.307 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.32 | 3.9 | -107.83 | 1 | 7 | -2 | 128 | 303.299 | 5 | ↓ |