| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2011 | 21 | Yes |
Popular Name: (2S)-2-cyclopropyl-3-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-(ethylamino)propan-1-ol (2S)-2-cyclopropyl-3-(3,5-dihydr…
| 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) | 2.07 | 6.2 | -104.73 | 4 | 4 | 2 | 51 | 292.423 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.07 | 4.9 | -4.35 | 2 | 4 | 0 | 45 | 290.407 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.07 | 6.16 | -31.06 | 3 | 4 | 1 | 46 | 291.415 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.07 | 4.61 | -33 | 3 | 4 | 1 | 49 | 291.415 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
