| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 18 | Yes |
Popular Name: 2-[4-[2-(cyclopropylamino)acetyl]-1,4-diazepan-1-yl]acetamide 2-[4-[2-(cyclopropylamino)acetyl…
| 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) | -1.29 | 2.55 | -94.69 | 5 | 6 | 2 | 84 | 256.35 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.29 | 0.93 | -43.99 | 4 | 6 | 1 | 83 | 255.342 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.29 | -0.36 | -11.72 | 3 | 6 | 0 | 79 | 254.334 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.29 | 1.26 | -40.71 | 4 | 6 | 1 | 80 | 255.342 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
