| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 17 | Yes |
Popular Name: 3-tert-butyl-5-(1,4-diazepan-1-ylmethyl)-1,2,4-oxadiazole 3-tert-butyl-5-(1,4-diazepan-1-y…
| 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) | 1.11 | 2.51 | -40.64 | 2 | 5 | 1 | 55 | 239.343 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.11 | 4.24 | -119.52 | 3 | 5 | 2 | 60 | 240.351 | 3 | ↓ |
