| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 21 | Yes |
Popular Name: 2-methyl-N-[[5-methyl-4-[(4-methyl-1,4-diazepan-1-yl)methyl]-2-furyl]methyl]propan-1-amine 2-methyl-N-[[5-methyl-4-[(4-meth…
| 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) | 1.99 | 10.11 | -176.54 | 4 | 4 | 3 | 39 | 296.479 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 8.11 | -91.6 | 3 | 4 | 2 | 37 | 295.471 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 8.08 | -81.18 | 3 | 4 | 2 | 37 | 295.471 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 6.12 | -38.28 | 2 | 4 | 1 | 36 | 294.463 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
