In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2005 | 22 | Yes |
Popular Name: 3-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzonitrile 3-[(5-methyl-4-phenyl-1,2,4-tria…
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) | 3.06 | 3.54 | -12.54 | 0 | 4 | 0 | 54 | 306.394 | 4 | ↓ |