| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2009 | 19 | Yes |
Popular Name: 5-chloro-1-[3-(1H-imidazol-1-yl)propyl]-1H-1,3-benzodiazol-2-amine 5-chloro-1-[3-(1H-imidazol-1-yl)…
Find On: PubMed — Wikipedia — Google
CAS Number: 1154368-05-4
| 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) | 1.91 | 10.07 | -16.76 | 2 | 5 | 0 | 62 | 275.743 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.91 | 10.58 | -45.99 | 3 | 5 | 1 | 63 | 276.751 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.91 | 11.06 | -87.37 | 4 | 5 | 2 | 64 | 277.759 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.91 | 10.54 | -41.19 | 3 | 5 | 1 | 63 | 276.751 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 229 - 231 | Enamine Building Blocks |
| MP | 229...231 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
