In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2010 | 15 | Yes |
Popular Name: [3-(5-ethyl-1H-1,2,4-triazol-3-yl)phenyl]methanamine [3-(5-ethyl-1H-1,2,4-triazol-3-y…
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 | 3.88 | -49.36 | 4 | 4 | 1 | 69 | 203.269 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.