| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 2nd, 2010 | 15 | Yes |
Popular Name: 4-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]aniline 4-[3-(propan-2-yl)-1H-1,2,4-tria…
Find On: PubMed — Wikipedia — Google
CAS Number: N/A
None
| 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) | 1.73 | 4.12 | -7.8 | 3 | 4 | 0 | 68 | 202.261 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.73 | 4.68 | -25.9 | 4 | 4 | 1 | 69 | 203.269 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.73 | 4.68 | -27.96 | 4 | 4 | 1 | 69 | 203.269 | 2 | ↓ |
