| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 24 | Yes |
Popular Name: N-[(1R)-1-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepane-1-carbonyl]butyl]acetamide N-[(1R)-1-[4-[(1-methylimidazol-…
| 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) | -0.04 | 5.18 | -15.14 | 1 | 7 | 0 | 70 | 335.452 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.04 | 5.41 | -35.21 | 2 | 7 | 1 | 72 | 336.46 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -0.04 | 7.04 | -48.56 | 2 | 7 | 1 | 72 | 336.46 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
