| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2008 | 20 | Yes |
Popular Name: (2-chlorophenyl)(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanamine (2-chlorophenyl)(3,4-dihydro-2H-…
Find On: PubMed — Wikipedia — Google
CAS Number: 1021079-84-4
| 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) | 3.31 | 6.51 | -57.27 | 3 | 3 | 1 | 46 | 290.77 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.31 | 6.16 | -8.52 | 2 | 3 | 0 | 44 | 289.762 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
