In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 9th, 2006 | 21 | Yes |
Popular Name: N,N-diethyl-2-[[5-(2-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl]acetamide N,N-diethyl-2-[[5-(2-fluoropheny…
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) | 2.64 | 8.09 | -13.15 | 1 | 5 | 0 | 62 | 308.382 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.64 | 7.89 | -51.24 | 0 | 5 | -1 | 60 | 307.374 | 6 | ↓ |