In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2006 | 25 | No |
Popular Name: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3-nitrophenyl)-ethanone 2-[(4-methyl-5-phenyl-1,2,4-tria…
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) | 3.58 | 2.08 | -17.38 | 0 | 7 | 0 | 93 | 354.391 | 6 | ↓ |