| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 20 | Yes |
Popular Name: 7-amino-6-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-4H-1,4-benzoxazin-3-one 7-amino-6-[(3R)-3-(dimethylamino…
| 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) | 0.62 | 3.23 | -43.08 | 4 | 6 | 1 | 72 | 277.348 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.62 | 0.84 | -6.35 | 3 | 6 | 0 | 71 | 276.34 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.62 | 3.12 | -109.86 | 5 | 6 | 2 | 74 | 278.356 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
