| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 17 | Yes |
Popular Name: N-methyl-1-[(2R,5S)-5-[(4-methyl-1,4-diazepan-1-yl)methyl]tetrahydrofuran-2-yl]methanamine N-methyl-1-[(2R,5S)-5-[(4-methyl…
| 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) | 0.65 | 6.57 | -182.91 | 4 | 4 | 3 | 35 | 244.403 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.65 | 2.25 | -35.83 | 2 | 4 | 1 | 32 | 242.387 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.65 | 4.72 | -85.47 | 3 | 4 | 2 | 34 | 243.395 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
