| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 2nd, 2012 | 18 | Yes |
Popular Name: 1-{[3-(1-ethoxyethyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepane 1-{[3-(1-ethoxyethyl)-1,2,4-oxad…
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CAS Number: 1354959-15-1
| 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) | 0.10 | 1.38 | -43.41 | 2 | 6 | 1 | 65 | 255.342 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.10 | 1.06 | -46.87 | 2 | 6 | 1 | 68 | 255.342 | 5 | ↓ |
| 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.
