| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 19 | Yes |
Popular Name: (2S)-2-amino-2-cyclopropyl-3-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)propanenitrile (2S)-2-amino-2-cyclopropyl-3-(3,…
| 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) | 1.74 | 4.19 | -7.87 | 2 | 4 | 0 | 62 | 257.337 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.74 | 5.93 | -43.75 | 3 | 4 | 1 | 63 | 258.345 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
