In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 1st, 2010 | 26 | No |
Popular Name: 3-(3-nitrophenyl)-5-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazole 3-(3-nitrophenyl)-5-(3,4,5-trime…
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) | 3.19 | 8.08 | -14.38 | 1 | 9 | 0 | 115 | 356.338 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.19 | 7.93 | -44.51 | 0 | 9 | -1 | 113 | 355.33 | 6 | ↓ |