| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 27th, 2007 | 18 | Yes |
Popular Name: 2-[[5-[(4-chlorophenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]acetonitrile 2-[[5-[(4-chlorophenoxy)methyl]-…
| 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) | 2.53 | 6.21 | -10.13 | 1 | 5 | 0 | 75 | 280.74 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.53 | 6.25 | -34.84 | 0 | 5 | -1 | 73 | 279.732 | 5 | ↓ |
