| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 7th, 2010 | 14 | Yes |
Popular Name: [1-(2-bromophenyl)-1H-1,2,3-triazol-4-yl]methanamine hydrochloride [1-(2-bromophenyl)-1H-1,2,3-tria…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1221725-81-0 , 1221820-94-5
| 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) | 1.52 | 3.02 | -51.24 | 3 | 4 | 1 | 58 | 254.111 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.52 | 2.61 | -12.93 | 2 | 4 | 0 | 57 | 253.103 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 247 - 249 | Enamine Building Blocks |
| MP | 247...249 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
