In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2008 | 18 | Yes |
Popular Name: 2-(3-phenyl-1H-1,2,4-triazol-5-yl)aniline 2-(3-phenyl-1H-1,2,4-triazol-5-y…
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CAS Number: 25518-15-4
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) | 3.06 | 6.87 | -7.87 | 3 | 4 | 0 | 68 | 236.278 | 2 | ↓ |
Ref Reference (pH 7) | 3.06 | 6.14 | -8.37 | 3 | 4 | 0 | 68 | 236.278 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 177 - 179 | Enamine Building Blocks |
MP | 177...179 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |