UCSF

ZINC00160781

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2005 18 No

Popular Name: ethyl 2-cyano-3-(3-nitrophenyl)acrylate ethyl 2-cyano-3-(3-nitrophenyl)a…

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CAS Number: 18925-00-3

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) 2.56 8.14 -9.25 0 6 0 96 246.222 5 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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