| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 21 | Yes |
Popular Name: 2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-6-methyl-pyridine-3-carboxamidine 2-(3,5-dihydro-2H-1,4-benzoxazep…
| 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) | 0.80 | 6.18 | -94.72 | 5 | 5 | 2 | 78 | 284.363 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.80 | 6.71 | -9.28 | 3 | 5 | 0 | 75 | 282.347 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.80 | 5.74 | -41.44 | 4 | 5 | 1 | 77 | 283.355 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
