UCSF

ZINC04779404

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 3rd, 2006 21 No

Popular Name: (2E)-3-[4-(2-ethoxy-2-oxoethoxy)-3-nitrophenyl]acrylic acid (2E)-3-[4-(2-ethoxy-2-oxoethoxy)…

Find On: PubMed — Wikipedia — Google

CAS Numbers: , 893764-59-5

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) 2.09 3.08 -57.4 0 8 -1 121 294.239 8 ↓

Activity (Go SEA)

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