In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 13 | Yes |
Popular Name: 3-methyl-5-(3-methylphenyl)-1H-1,2,4-triazole 3-methyl-5-(3-methylphenyl)-1H-1…
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CAS Number: 1094688-08-0
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) | 2.02 | 5.85 | -7.14 | 1 | 3 | 0 | 42 | 173.219 | 1 | ↓ |
Ref Reference (pH 7) | 2.02 | 5.88 | -8.91 | 1 | 3 | 0 | 42 | 173.219 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 140 - 142 | Enamine Building Blocks |
MP | 140...142 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |