In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2010 | 17 | Yes |
Popular Name: N-(4-acetylphenyl)-1,1,1-trifluoro-methanesulfonamide N-(4-acetylphenyl)-1,1,1-trifluo…
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) | 4.62 | 2.27 | -34.53 | 0 | 4 | -1 | 65 | 266.22 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.62 | 2.11 | -11.92 | 1 | 4 | 0 | 63 | 267.228 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4076519; US4163659; US5242928; US5389642; US5438063; US5684015 | IBM Patent Data |