In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2011 | 18 | Yes |
Popular Name: 4-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-1,4-diazepane-1-carboxamide 4-[(3-ethyl-1,2,4-oxadiazol-5-yl…
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) | -0.17 | 1.93 | -49.12 | 3 | 7 | 1 | 90 | 254.314 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.