| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 22nd, 2011 | 20 | Yes |
Popular Name: 2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N,N-dimethyl-ethanamine 2-[(4-allyl-5-phenyl-1,2,4-triaz…
| 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) | 3.17 | 10.71 | -41.94 | 1 | 4 | 1 | 35 | 289.428 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.17 | 8.23 | -10.22 | 0 | 4 | 0 | 34 | 288.42 | 7 | ↓ |
