In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 25th, 2007 | 19 | Yes |
Popular Name: 5,6-diphenyl-1,2,4-triazin-3-ol 5,6-diphenyl-1,2,4-triazin-3-ol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 4512-00-9 , [4512-00-9]
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) | 3.14 | 2.9 | -55.52 | 0 | 4 | -1 | 62 | 248.265 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 2.240000000000000e+002 - 2.250000000000000e+002 | KeyOrganics |
MP | 222 - 224 | Enamine Building Blocks |
MP | 222...224 | Enamine Building Blocks |
melting_point | 224 - 225 | KeyOrganics |
MP | 224-225° | Matrix Scientific |
mp | 252 | MolMall (formerly Molecular Diversity Preservation International) |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |