| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 17 | Yes |
Popular Name: N-methyl-1-[2-[(4-methyl-1,4-diazepan-1-yl)methyl]-3-furyl]methanamine N-methyl-1-[2-[(4-methyl-1,4-dia…
| 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 | 5.84 | -91.03 | 3 | 4 | 2 | 37 | 239.363 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.65 | 5.06 | -105.85 | 3 | 4 | 2 | 37 | 239.363 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.65 | 7.24 | -200.31 | 4 | 4 | 3 | 39 | 240.371 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
