| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2009 | 16 | Yes |
Popular Name: 3-fluoro-4-(4-methyl-1,4-diazepan-1-yl)aniline 3-fluoro-4-(4-methyl-1,4-diazepa…
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CAS Number: 873537-30-5
| 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) | 1.37 | 4.63 | -37.73 | 3 | 3 | 1 | 34 | 224.303 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.37 | 2.18 | -5.57 | 2 | 3 | 0 | 32 | 223.295 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 43 - 45 | Enamine Building Blocks |
| MP | 43...45 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
