| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 22 | Yes |
Popular Name: 2,2-dimethyl-1-[4-(pyridine-4-carbonyl)-1,4-diazepan-1-yl]butan-1-one 2,2-dimethyl-1-[4-(pyridine-4-ca…
| 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) | 1.14 | 6.59 | -15.79 | 0 | 5 | 0 | 54 | 303.406 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
