In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 33 | Yes |
Popular Name: 4-[[4-benzyl-5-(3-isopropoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzoic 4-[[4-benzyl-5-(3-isopropoxyphen…
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) | 6.37 | 16.3 | -54.3 | 0 | 6 | -1 | 80 | 458.563 | 9 | ↓ |