| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 14th, 2010 | 24 | Yes |
Popular Name: 1-(3-allyl-4-ethoxy-phenyl)-N-[(4-isopropyl-1,2,4-triazol-3-yl)methyl]-N-methyl-methanamine 1-(3-allyl-4-ethoxy-phenyl)-N-[(…
| 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) | 2.69 | 12.58 | -48.51 | 1 | 5 | 1 | 44 | 329.468 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.69 | 10.28 | -11.23 | 0 | 5 | 0 | 43 | 328.46 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
