| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2008 | 16 | Yes |
Popular Name: 1-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]ethan-1-amine dihydrochloride 1-[4-(3,5-dimethyl-1H-pyrazol-1-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1354960-36-3 , 956806-26-1
| 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) | -0.03 | 5.35 | -56.29 | 3 | 3 | 1 | 45 | 216.308 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.03 | 5.02 | -8.47 | 2 | 3 | 0 | 44 | 215.3 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
