In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 27 | Yes |
Popular Name: N-(2-iodophenyl)-2-[[5-(3-isopropoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl]acetamide N-(2-iodophenyl)-2-[[5-(3-isopro…
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) | 5.04 | 9.95 | -9.87 | 2 | 6 | 0 | 80 | 494.358 | 7 | ↓ |
Hi High (pH 8-9.5) | 5.04 | 9.75 | -44.95 | 1 | 6 | -1 | 78 | 493.35 | 7 | ↓ |