| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 19 | Yes |
Popular Name: N-butyl-N-[[3-[(isopropylamino)methyl]isoxazol-5-yl]methyl]cyclopropanamine N-butyl-N-[[3-[(isopropylamino)m…
| 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) | 2.74 | 8.54 | -92.36 | 3 | 4 | 2 | 47 | 267.417 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.74 | 7.33 | -39.31 | 2 | 4 | 1 | 42 | 266.409 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
