In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 29th, 2007 | 21 | Yes |
Popular Name: N-(3-fluoro-4-methyl-phenyl)-2-[(5-isopropyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide N-(3-fluoro-4-methyl-phenyl)-2-[…
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) | 2.80 | 6.51 | -9.82 | 2 | 5 | 0 | 71 | 308.382 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.80 | 6.32 | -42.45 | 1 | 5 | -1 | 69 | 307.374 | 5 | ↓ |