| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 15th, 2010 | 12 | No |
Popular Name: 4-fluoro-N'-hydroxy-3-methylbenzene-1-carboximidamide 4-fluoro-N'-hydroxy-3-methylbenz…
Find On: PubMed — Wikipedia — Google
CAS Number: 175277-86-8
| 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) | 0.79 | 1.87 | -6.61 | 3 | 3 | 0 | 59 | 168.171 | 1 | ↓ |
| Ref Reference (pH 7) | 0.92 | 1.91 | -33.58 | 4 | 3 | 1 | 58 | 169.179 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.92 | 2.93 | -17.68 | 3 | 3 | 0 | 61 | 168.171 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.79 | 1.82 | -35.86 | 4 | 3 | 1 | 60 | 169.179 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.79 | 1.91 | -33.62 | 4 | 3 | 1 | 60 | 169.179 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.