| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2009 | 29 | Yes |
Popular Name: 4-benzyl-3-[(3-methylphenoxy)methyl]-5-(2-pyrrolidin-1-ylethylsulfanyl)-1,2,4-triazole 4-benzyl-3-[(3-methylphenoxy)met…
| 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) | 4.59 | 14.83 | -43.03 | 1 | 5 | 1 | 44 | 409.579 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.59 | 12.37 | -11.04 | 0 | 5 | 0 | 43 | 408.571 | 9 | ↓ |
