In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 12th, 2006 | 19 | Yes |
Popular Name: 2-[(5-benzo[1,3]dioxol-5-yl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetonitrile 2-[(5-benzo[1,3]dioxol-5-yl-4-me…
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) | 2.17 | 6.49 | -11.91 | 0 | 6 | 0 | 73 | 274.305 | 3 | ↓ |