| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 19 | No |
Popular Name: (3R,4S)-4-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1,1-dioxo-thiolan-3-amine (3R,4S)-4-(3,5-dihydro-2H-1,4-be…
| 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) | -0.28 | 0.36 | -12.53 | 2 | 5 | 0 | 73 | 282.365 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.28 | 1.79 | -50.34 | 3 | 5 | 1 | 74 | 283.373 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.28 | 0.69 | -61.78 | 3 | 5 | 1 | 74 | 283.373 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
