In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2011 | 20 | Yes |
Popular Name: [2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-4-ethyl-thiazol-5-yl]methanol [2-(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) | 2.73 | 5.06 | -11.38 | 1 | 4 | 0 | 46 | 290.388 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.73 | 5.51 | -27.6 | 2 | 4 | 1 | 47 | 291.396 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.