| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2010 | 13 | Yes |
Popular Name: N-[(4-isopropyl-5-methyl-1,2,4-triazol-3-yl)methyl]ethanamine N-[(4-isopropyl-5-methyl-1,2,4-t…
| 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) | 0.33 | 5.26 | -44.68 | 2 | 4 | 1 | 47 | 183.279 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.33 | 3.9 | -8.99 | 1 | 4 | 0 | 43 | 182.271 | 4 | ↓ |
