| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 19 | Yes |
Popular Name: N-[2-[4-[(isopropylamino)methyl]triazol-1-yl]ethyl]-3-methoxy-N-methyl-propan-1-amine N-[2-[4-[(isopropylamino)methyl]…
| 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) | 0.61 | 4.89 | -97.03 | 3 | 6 | 2 | 61 | 271.409 | 10 | ↓ |
| Hi High (pH 8-9.5) | 0.61 | 2.57 | -41.36 | 2 | 6 | 1 | 60 | 270.401 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
