| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 16 | Yes |
Popular Name: N-[[4-(1,2,4-triazol-1-ylmethyl)thiazol-2-yl]methyl]propan-1-amine N-[[4-(1,2,4-triazol-1-ylmethyl)…
| 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) | 0.39 | 6.2 | -43.22 | 2 | 5 | 1 | 60 | 238.34 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | 4.84 | -10.83 | 1 | 5 | 0 | 56 | 237.332 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
