UCSF

ZINC00167654

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 20 No

Popular Name: 3-[2-(4-methoxyphenoxy)phenyl]prop-2-enoic acid 3-[2-(4-methoxyphenoxy)phenyl]pr…

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CAS Number: 1164549-12-5

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) 3.49 8.51 -54.77 0 4 -1 59 269.276 5 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 208 - 210 KeyOrganics
MP 208-210° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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