In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2005 | 31 | Yes |
Popular Name: 3-[[5-(3,4-dimethoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile 3-[[5-(3,4-dimethoxyphenyl)-4-ph…
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) | 4.74 | 3.92 | -15.61 | 0 | 6 | 0 | 72 | 428.517 | 7 | ↓ |