UCSF

ZINC12167544

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 3rd, 2008 34 No

Popular Name: (E)-N-[[5-benzylsulfanyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-3-(3-fluorophenyl)prop-2-ena (E)-N-[[5-benzylsulfanyl-4-(4-me…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Physical Representations

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 1.13 -13.81 1 6 0 69 474.561 9 ↓

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )