| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 20 | Yes |
Popular Name: N-butyl-N-[[2-[(tert-butylamino)methyl]thiazol-4-yl]methyl]cyclopropanamine N-butyl-N-[[2-[(tert-butylamino)…
| 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) | 3.19 | 8.53 | -84.49 | 3 | 3 | 2 | 34 | 297.512 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.19 | 5.25 | -3.22 | 1 | 3 | 0 | 28 | 295.496 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.19 | 7.29 | -30.99 | 2 | 3 | 1 | 29 | 296.504 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
