In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 17th, 2009 | 28 | Yes |
Popular Name: 2-cyano-N-(5-isopropyl-1-methyl-3-oxo-2-phenyl-pyrazol-4-yl)benzenesulfonamide 2-cyano-N-(5-isopropyl-1-methyl-…
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) | 2.86 | 6.4 | -33.04 | 1 | 7 | 0 | 97 | 396.472 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.86 | 6.48 | -74.47 | 0 | 7 | -1 | 99 | 395.464 | 5 | ↓ |