| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 19 | Yes |
Popular Name: 4-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-3-methyl-aniline 4-(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) | 2.76 | 7 | -4.71 | 2 | 3 | 0 | 38 | 254.333 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.76 | 6.86 | -44.32 | 3 | 3 | 1 | 40 | 255.341 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.76 | 7.08 | -28.36 | 3 | 3 | 1 | 40 | 255.341 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
