In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 18th, 2007 | 28 | Yes |
Popular Name: 4-[2-[[4-ethyl-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]benzonitrile 4-[2-[[4-ethyl-5-[(4-methoxyphen…
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) | 3.78 | 3.43 | -15.16 | 0 | 6 | 0 | 80 | 392.484 | 8 | ↓ |