In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 15th, 2006 | 28 | Yes |
Popular Name: N-(2,6-diethylphenyl)-2-[[5-(4-ethylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl]acetamide N-(2,6-diethylphenyl)-2-[[5-(4-e…
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) | 4.94 | 12.18 | -10.66 | 2 | 5 | 0 | 71 | 394.544 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.94 | 11.98 | -47.72 | 1 | 5 | -1 | 69 | 393.536 | 8 | ↓ |