| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 16 | Yes |
Popular Name: N-[[4-[[methyl(propyl)amino]methyl]thiazol-2-yl]methyl]cyclopropanamine N-[[4-[[methyl(propyl)amino]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) | 1.45 | 6.72 | -87.37 | 3 | 3 | 2 | 34 | 241.404 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 5.43 | -32.89 | 2 | 3 | 1 | 29 | 240.396 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 4.38 | -35.54 | 2 | 3 | 1 | 33 | 240.396 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 3.08 | -3.34 | 1 | 3 | 0 | 28 | 239.388 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
