| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 20 | Yes |
Popular Name: N-[[4-[[butyl-[(1R)-1-methylpropyl]amino]methyl]thiazol-2-yl]methyl]cyclopropanamine N-[[4-[[butyl-[(1R)-1-methylprop…
| 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) | 3.21 | 9.09 | -85.27 | 3 | 3 | 2 | 34 | 297.512 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.21 | 7.86 | -35.73 | 2 | 3 | 1 | 33 | 296.504 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.21 | 7.81 | -32.09 | 2 | 3 | 1 | 29 | 296.504 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.21 | 6.56 | -1.96 | 1 | 3 | 0 | 28 | 295.496 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
