| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 19 | Yes |
Popular Name: [4-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)thiazol-2-yl]methanamine [4-(3,5-dihydro-2H-1,4-benzoxaze…
| 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) | 1.10 | 2.21 | -46.66 | 3 | 4 | 1 | 53 | 276.385 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.10 | 1.81 | -8.18 | 2 | 4 | 0 | 51 | 275.377 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.10 | 4.29 | -98.12 | 4 | 4 | 2 | 54 | 277.393 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
