In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 28 | No |
Popular Name: N-[(4-methoxyphenyl)methyl]-2-[[5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl]acetamide N-[(4-methoxyphenyl)methyl]-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) | 2.92 | 7.89 | -16.1 | 2 | 9 | 0 | 126 | 399.432 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.92 | 7.7 | -45.8 | 1 | 9 | -1 | 124 | 398.424 | 8 | ↓ |