| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2008 | 11 | Yes |
Popular Name: 2-(3-cyclopropyl-4H-1,2,4-triazol-4-yl)ethan-1-amine dihydrochloride 2-(3-cyclopropyl-4H-1,2,4-triazo…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1315366-73-4 , 1315449-55-8
| 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) | -1.28 | 4.15 | -61.85 | 3 | 4 | 1 | 58 | 153.209 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.28 | 3.77 | -9.83 | 2 | 4 | 0 | 57 | 152.201 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 166 - 168 | Enamine Building Blocks |
| MP | 166...168 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.
