In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 18th, 2007 | 31 | Yes |
Popular Name: N-[1-[4-allyl-5-[2-(4-cyanophenyl)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethyl]benzamide N-[1-[4-allyl-5-[2-(4-cyanopheny…
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) | 3.18 | 2.18 | -14.52 | 1 | 7 | 0 | 100 | 431.521 | 9 | ↓ |