In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 25th, 2008 | 32 | Yes |
Popular Name: 3-[[4-benzyl-5-[(3,4-dimethylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile 3-[[4-benzyl-5-[(3,4-dimethylphe…
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) | 5.88 | 16.47 | -14.1 | 0 | 5 | 0 | 64 | 440.572 | 8 | ↓ |