| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2011 | 18 | No |
Popular Name: (6S,7R)-6-amino-1-methyl-7-(5-nitro-2-furyl)azepan-2-one (6S,7R)-6-amino-1-methyl-7-(5-ni…
| 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) | 0.36 | 3.09 | -60.7 | 3 | 7 | 1 | 107 | 254.266 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.36 | 2.72 | -9.84 | 2 | 7 | 0 | 105 | 253.258 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
