| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 23 | Yes |
Popular Name: 2-[(3S)-4-(2-methoxyethyl)-3-methyl-piperazin-1-yl]-N-[(3R)-2-oxoazepan-3-yl]acetamide 2-[(3S)-4-(2-methoxyethyl)-3-met…
| 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) | 0.16 | 2.16 | -42.75 | 3 | 7 | 1 | 75 | 327.449 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.16 | -0.09 | -18.13 | 2 | 7 | 0 | 74 | 326.441 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
