| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 19 | Yes |
Popular Name: N-ethyl-N-methyl-N'-[(2-phenyltriazol-4-yl)methyl]ethane-1,2-diamine N-ethyl-N-methyl-N'-[(2-phenyltr…
| 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) | 1.33 | 6.99 | -118.3 | 3 | 5 | 2 | 52 | 261.373 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.33 | 3.31 | -7.01 | 1 | 5 | 0 | 46 | 259.357 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.33 | 5.64 | -38.68 | 2 | 5 | 1 | 47 | 260.365 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.33 | 4.67 | -44.03 | 2 | 5 | 1 | 51 | 260.365 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
