In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2005 | 27 | Yes |
Popular Name: 4-[[5-(4-chlorophenyl)-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile 4-[[5-(4-chlorophenyl)-4-(3-meth…
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) | 4.78 | 2.37 | -12.55 | 0 | 5 | 0 | 63 | 398.919 | 8 | ↓ |