| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 14 | Yes |
Popular Name: 1-[3-(1H-imidazol-1-ylmethyl)phenyl]methanamine 1-[3-(1H-imidazol-1-ylmethyl)phe…
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CAS Number: 159148-87-5
| 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) | 0.75 | 5.75 | -53.25 | 3 | 3 | 1 | 45 | 188.254 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.75 | 5.36 | -8.33 | 2 | 3 | 0 | 44 | 187.246 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.75 | 6.24 | -90.93 | 4 | 3 | 2 | 47 | 189.262 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
