| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 20 | Yes |
Popular Name: N-cycloheptyl-2-[[(1R,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]amino]acetamide N-cycloheptyl-2-[[(1R,8R)-2,3,5,…
| 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) | 2.65 | 5.82 | -37.1 | 3 | 4 | 1 | 46 | 280.436 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.65 | 4.28 | -41.49 | 3 | 4 | 1 | 49 | 280.436 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.65 | 3.35 | -6.72 | 2 | 4 | 0 | 44 | 279.428 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.65 | 6.76 | -108.3 | 4 | 4 | 2 | 50 | 281.444 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
